CAS RN: 4706-91-6
CAS Name: 2,3,4,5-tetrachlorobenzenethiol
OPENEYE Name: 2,3,4,5-tetrachlorobenzenethiol
IUPAC Name: 2,3,4,5-tetrachlorobenzenethiol
SYSTEMATIC NAME: 2,3,4,5-tetrakis(chloranyl)benzenethiol
MOLECULAR FORMULA: C6H2Cl4S
MOLECULAR WEIGHT: 247.95708
SMILES: C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)S
Structure:
CAS RN: 4706-65-4
CAS Name: 1-octadecanamine; sulfuric acid
OPENEYE Name: octadecan-1-amine; sulfuric acid
IUPAC Name: octadecan-1-amine; sulfuric acid
SYSTEMATIC NAME: octadecan-1-amine; sulfuric acid
MOLECULAR FORMULA: C18H41NO4S
MOLECULAR WEIGHT: 367.58744
SMILES: CCCCCCCCCCCCCCCCCCN.OS(=O)(=O)O
Structure:
CAS RN: 4692-79-9
CAS Name: diethyl(diphenyl)plumbane
OPENEYE Name: diethyl(diphenyl)plumbane
IUPAC Name: diethyl(diphenyl)plumbane
SYSTEMATIC NAME: diethyl(diphenyl)plumbane
MOLECULAR FORMULA: C16H20Pb
MOLECULAR WEIGHT: 419.53
SMILES: CC[Pb](CC)(C1=CC=CC=C1)C2=CC=CC=C2
Structure:
CAS RN: 4681-11-2
CAS Name: 2,3,6-trichlorobenzonitrile
OPENEYE Name: 2,3,6-trichlorobenzonitrile
IUPAC Name: 2,3,6-trichlorobenzonitrile
SYSTEMATIC NAME: 2,3,6-tris(chloranyl)benzenecarbonitrile
MOLECULAR FORMULA: C7H2Cl3N
MOLECULAR WEIGHT: 206.45648
SMILES: C1=CC(=C(C(=C1Cl)C#N)Cl)Cl
Structure:
CAS RN: 4632-51-3
CAS Name: 2-(1-naphthalenyl)thiophene
OPENEYE Name: 2-(1-naphthyl)thiophene
IUPAC Name: 2-naphthalen-1-ylthiophene
SYSTEMATIC NAME: 2-naphthalen-1-ylthiophene
MOLECULAR FORMULA: C14H10S
MOLECULAR WEIGHT: 210.2942
SMILES: C1=CC=C2C(=C1)C=CC=C2C3=CC=CS3
Structure:
CAS RN: 4587-19-3
CAS Name: tetraethylammonium thiocyanate
OPENEYE Name: tetraethylammonium thiocyanate
IUPAC Name: tetraethylazanium thiocyanate
SYSTEMATIC NAME: tetraethylazanium thiocyanate
MOLECULAR FORMULA: C9H20N2S
MOLECULAR WEIGHT: 188.3335
SMILES: CC[N+](CC)(CC)CC.C(#N)[S-]
Structure:
CAS RN: 4540-16-3
CAS Name: 1-ethenylpyrrolidine
OPENEYE Name: 1-vinylpyrrolidine
IUPAC Name: 1-ethenylpyrrolidine
SYSTEMATIC NAME: 1-ethenylpyrrolidine
MOLECULAR FORMULA: C6H11N
MOLECULAR WEIGHT: 97.15824
SMILES: C=CN1CCCC1
Structure:
CAS RN: 4532-02-9
CAS Name: phosphoric acid diethyl (2-nitrophenyl) ester
OPENEYE Name: diethyl (2-nitrophenyl) phosphate
IUPAC Name: diethyl (2-nitrophenyl) phosphate
SYSTEMATIC NAME: diethyl (2-nitrophenyl) phosphate
MOLECULAR FORMULA: C10H14NO6P
MOLECULAR WEIGHT: 275.195021
SMILES: CCOP(=O)(OCC)OC1=CC=CC=C1[N+](=O)[O-]
Structure:
CAS RN: 4488-40-8
CAS Name: 4-methyl-1-naphthalenecarboxylic acid
OPENEYE Name: 4-methylnaphthalene-1-carboxylic acid
IUPAC Name: 4-methylnaphthalene-1-carboxylic acid
SYSTEMATIC NAME: 4-methylnaphthalene-1-carboxylic acid
MOLECULAR FORMULA: C12H10O2
MOLECULAR WEIGHT: 186.2066
SMILES: CC1=CC=C(C2=CC=CC=C12)C(=O)O
Structure:
CAS RN: 4481-28-1
CAS Name: 3-carbamoylbenzoic acid
OPENEYE Name: 3-carbamoylbenzoic acid
IUPAC Name: 3-carbamoylbenzoic acid
SYSTEMATIC NAME: 3-aminocarbonylbenzoic acid
MOLECULAR FORMULA: C8H7NO3
MOLECULAR WEIGHT: 165.14608
SMILES: C1=CC(=CC(=C1)C(=O)O)C(=O)N
Structure:
CAS RN: 4467-92-9
CAS Name: 2,4-dinitro-6-octylphenol
OPENEYE Name: 2,4-dinitro-6-octyl-phenol
IUPAC Name: 2,4-dinitro-6-octylphenol
SYSTEMATIC NAME: 2,4-dinitro-6-octyl-phenol
MOLECULAR FORMULA: C14H20N2O5
MOLECULAR WEIGHT: 296.319
SMILES: CCCCCCCCC1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 4412-05-9
CAS Name: 3-methyl-2-(1-methylethenyl)-2-butenoic acid
OPENEYE Name: 2-isopropenyl-3-methyl-but-2-enoic acid
IUPAC Name: 3-methyl-2-prop-1-en-2-ylbut-2-enoic acid
SYSTEMATIC NAME: 3-methyl-2-prop-1-en-2-yl-but-2-enoic acid
MOLECULAR FORMULA: C8H12O2
MOLECULAR WEIGHT: 140.17968
SMILES: CC(=C(C(=C)C)C(=O)O)C
Structure:
CAS RN: 4387-30-8
CAS Name: 4-chlorobenzene-1,3-dicarbonitrile
OPENEYE Name: 4-chlorobenzene-1,3-dicarbonitrile
IUPAC Name: 4-chlorobenzene-1,3-dicarbonitrile
SYSTEMATIC NAME: 4-chloranylbenzene-1,3-dicarbonitrile
MOLECULAR FORMULA: C8H3ClN2
MOLECULAR WEIGHT: 162.57582
SMILES: C1=CC(=C(C=C1C#N)C#N)Cl
Structure:
CAS RN: 4383-81-7
CAS Name: 2,6-diamino-N-hydroxyhexanamide
OPENEYE Name: 2,6-diaminohexanehydroxamic acid
IUPAC Name: 2,6-diamino-N-hydroxyhexanamide
SYSTEMATIC NAME: 2,6-bis(azanyl)-N-oxidanyl-hexanamide
MOLECULAR FORMULA: C6H15N3O2
MOLECULAR WEIGHT: 161.2022
SMILES: C(CCN)CC(C(=O)NO)N
Structure:
CAS RN: 4291-32-1
CAS Name: 4-(3,5-dichlorophenyl)phenol
OPENEYE Name: 4-(3,5-dichlorophenyl)phenol
IUPAC Name: 4-(3,5-dichlorophenyl)phenol
SYSTEMATIC NAME: 4-[3,5-bis(chloranyl)phenyl]phenol
MOLECULAR FORMULA: C12H8Cl2O
MOLECULAR WEIGHT: 239.09732
SMILES: C1=CC(=CC=C1C2=CC(=CC(=C2)Cl)Cl)O
Structure:
CAS RN: 4214-44-2
CAS Name: 3,5-dibromo-N-(2-bromophenyl)-2-hydroxybenzamide
OPENEYE Name: 3,5-dibromo-N-(2-bromophenyl)-2-hydroxy-benzamide
IUPAC Name: 3,5-dibromo-N-(2-bromophenyl)-2-hydroxybenzamide
SYSTEMATIC NAME: 3,5-bis(bromanyl)-N-(2-bromophenyl)-2-oxidanyl-benzamide
MOLECULAR FORMULA: C13H8Br3NO2
MOLECULAR WEIGHT: 449.92012
SMILES: C1=CC=C(C(=C1)NC(=O)C2=CC(=CC(=C2O)Br)Br)Br
Structure:
CAS RN: 4182-71-2
CAS Name: 2,4-dinitro-6-pentylphenol
OPENEYE Name: 2,4-dinitro-6-pentyl-phenol
IUPAC Name: 2,4-dinitro-6-pentylphenol
SYSTEMATIC NAME: 2,4-dinitro-6-pentyl-phenol
MOLECULAR FORMULA: C11H14N2O5
MOLECULAR WEIGHT: 254.23926
SMILES: CCCCCC1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 4107-64-6
CAS Name: 1-pyrenecarbonitrile
OPENEYE Name: pyrene-1-carbonitrile
IUPAC Name: pyrene-1-carbonitrile
SYSTEMATIC NAME: pyrene-1-carbonitrile
MOLECULAR FORMULA: C17H9N
MOLECULAR WEIGHT: 227.26006
SMILES: C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C#N
Structure:
CAS RN: 4099-73-4
CAS Name: 2-butyl-4,6-dinitrophenol
OPENEYE Name: 2-butyl-4,6-dinitro-phenol
IUPAC Name: 2-butyl-4,6-dinitrophenol
SYSTEMATIC NAME: 2-butyl-4,6-dinitro-phenol
MOLECULAR FORMULA: C10H12N2O5
MOLECULAR WEIGHT: 240.21268
SMILES: CCCCC1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 4099-72-3
CAS Name: 2,4-dinitro-6-propylphenol
OPENEYE Name: 2,4-dinitro-6-propyl-phenol
IUPAC Name: 2,4-dinitro-6-propylphenol
SYSTEMATIC NAME: 2,4-dinitro-6-propyl-phenol
MOLECULAR FORMULA: C9H10N2O5
MOLECULAR WEIGHT: 226.1861
SMILES: CCCC1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 4099-67-6
CAS Name: 2,4-dinitro-6-nonylphenol
OPENEYE Name: 2,4-dinitro-6-nonyl-phenol
IUPAC Name: 2,4-dinitro-6-nonylphenol
SYSTEMATIC NAME: 2,4-dinitro-6-nonyl-phenol
MOLECULAR FORMULA: C15H22N2O5
MOLECULAR WEIGHT: 310.34558
SMILES: CCCCCCCCCC1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 4099-66-5
CAS Name: 2-heptyl-4,6-dinitrophenol
OPENEYE Name: 2-heptyl-4,6-dinitro-phenol
IUPAC Name: 2-heptyl-4,6-dinitrophenol
SYSTEMATIC NAME: 2-heptyl-4,6-dinitro-phenol
MOLECULAR FORMULA: C13H18N2O5
MOLECULAR WEIGHT: 282.29242
SMILES: CCCCCCCC1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 4095-54-9
CAS Name: 2,6-dinitro-4-octan-2-ylphenol
OPENEYE Name: 4-(1-methylheptyl)-2,6-dinitro-phenol
IUPAC Name: 2,6-dinitro-4-octan-2-ylphenol
SYSTEMATIC NAME: 2,6-dinitro-4-octan-2-yl-phenol
MOLECULAR FORMULA: C14H20N2O5
MOLECULAR WEIGHT: 296.319
SMILES: CCCCCCC(C)C1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]
Structure:
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