AB61017
402-13-1 | 2-Amino-4-(trifluoromethyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB61017
ChemicalName
2-Amino-4-(trifluoromethyl)benzoic acid
CasNumber
402-13-1
MolecularFormula
C8H6F3NO2
MolecularWeight
205.1339
MdlNumber
MFCD00519334
Smiles
OC(=O)c1ccc(cc1N)C(F)(F)F
Complexity
229
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
2.3
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CatalogNumber: AB61017
ChemicalName: 2-Amino-4-(trifluoromethyl)benzoic acid
CasNumber: 402-13-1
MolecularFormula: C8H6F3NO2
MolecularWeight: 205.1339
MdlNumber: MFCD00519334
Smiles: OC(=O)c1ccc(cc1N)C(F)(F)F
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AB61017
ChemicalName:
2-Amino-4-(trifluoromethyl)benzoic acid
CasNumber:
402-13-1
MolecularFormula:
C8H6F3NO2
MolecularWeight:
205.1339
MdlNumber:
MFCD00519334
Smiles:
OC(=O)c1ccc(cc1N)C(F)(F)F
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: AB61018
ChemicalName: 4-(Trifluoromethyl)pyridin-2-amine
CasNumber: 106447-97-6
MolecularFormula: C6H5F3N2
MolecularWeight: 162.1125096
MdlNumber: MFCD00077455
Smiles: Nc1nccc(c1)C(F)(F)F
Complexity: 134
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 1.1
CatalogNumber:
AB61018
ChemicalName:
4-(Trifluoromethyl)pyridin-2-amine
CasNumber:
106447-97-6
MolecularFormula:
C6H5F3N2
MolecularWeight:
162.1125096
MdlNumber:
MFCD00077455
Smiles:
Nc1nccc(c1)C(F)(F)F
Complexity:
134
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
1.1
CatalogNumber: AB61019
ChemicalName: 2-Amino-4-(trifluoromethyl)thiazole-5-carboxylic acid
CasNumber: 239135-55-8
MolecularFormula: C5H3F3N2O2S
MolecularWeight: 212.1497
MdlNumber: MFCD00269431
Smiles: Nc1sc(c(n1)C(F)(F)F)C(=O)O
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.4
CatalogNumber:
AB61019
ChemicalName:
2-Amino-4-(trifluoromethyl)thiazole-5-carboxylic acid
CasNumber:
239135-55-8
MolecularFormula:
C5H3F3N2O2S
MolecularWeight:
212.1497
MdlNumber:
MFCD00269431
Smiles:
Nc1sc(c(n1)C(F)(F)F)C(=O)O
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.4
CatalogNumber: AB61020
ChemicalName: 2-Amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CasNumber: 4815-28-5
MolecularFormula: C9H12N2OS
MolecularWeight: 196.2694
MdlNumber: MFCD00111277
Smiles: NC(=O)c1c(N)sc2c1CCCC2
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AB61020
ChemicalName:
2-Amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CasNumber:
4815-28-5
MolecularFormula:
C9H12N2OS
MolecularWeight:
196.2694
MdlNumber:
MFCD00111277
Smiles:
NC(=O)c1c(N)sc2c1CCCC2
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.9