AB61072
619-17-0 | 2-Amino-4-nitrobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB61072
ChemicalName
2-Amino-4-nitrobenzoic acid
CasNumber
619-17-0
MolecularFormula
C7H6N2O4
MolecularWeight
182.13354
MdlNumber
MFCD00007262
Smiles
OC(=O)c1ccc(cc1N)[N+](=O)[O-]
NscNumber
7789
Complexity
225
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
1.9
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CatalogNumber: AB61072
ChemicalName: 2-Amino-4-nitrobenzoic acid
CasNumber: 619-17-0
MolecularFormula: C7H6N2O4
MolecularWeight: 182.13354
MdlNumber: MFCD00007262
Smiles: OC(=O)c1ccc(cc1N)[N+](=O)[O-]
NscNumber: 7789
Complexity: 225
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AB61072
ChemicalName:
2-Amino-4-nitrobenzoic acid
CasNumber:
619-17-0
MolecularFormula:
C7H6N2O4
MolecularWeight:
182.13354
MdlNumber:
MFCD00007262
Smiles:
OC(=O)c1ccc(cc1N)[N+](=O)[O-]
NscNumber:
7789
Complexity:
225
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=N(=O)c1ccc(c(c1)N)O
NscNumber: __
Complexity: 156
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=N(=O)c1ccc(c(c1)N)O
NscNumber:
__
Complexity:
156
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5
CatalogNumber: AB61074
ChemicalName: 4-O-Tolyl-thiazol-2-ylamine
CasNumber: 5330-79-0
MolecularFormula: C10H10N2S
MolecularWeight: 190.2648
MdlNumber: MFCD02664017
Smiles: Nc1scc(n1)c1ccccc1C
NscNumber: 2524
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AB61074
ChemicalName:
4-O-Tolyl-thiazol-2-ylamine
CasNumber:
5330-79-0
MolecularFormula:
C10H10N2S
MolecularWeight:
190.2648
MdlNumber:
MFCD02664017
Smiles:
Nc1scc(n1)c1ccccc1C
NscNumber:
2524
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1c[nH]c2c1c(=O)[nH]c(n2)N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1c[nH]c2c1c(=O)[nH]c(n2)N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__