AB61071
196194-99-7 | 2-Amino-4-nitro-5-methoxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB61071
ChemicalName
2-Amino-4-nitro-5-methoxybenzoic acid
CasNumber
196194-99-7
MolecularFormula
C8H8N2O5
MolecularWeight
212.15952000000004
MdlNumber
MFCD10568169
Smiles
COc1cc(C(=O)O)c(cc1[N+](=O)[O-])N
Complexity
264
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.6
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CatalogNumber: AB61071
ChemicalName: 2-Amino-4-nitro-5-methoxybenzoic acid
CasNumber: 196194-99-7
MolecularFormula: C8H8N2O5
MolecularWeight: 212.15952000000004
MdlNumber: MFCD10568169
Smiles: COc1cc(C(=O)O)c(cc1[N+](=O)[O-])N
Complexity: 264
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.6
CatalogNumber:
AB61071
ChemicalName:
2-Amino-4-nitro-5-methoxybenzoic acid
CasNumber:
196194-99-7
MolecularFormula:
C8H8N2O5
MolecularWeight:
212.15952000000004
MdlNumber:
MFCD10568169
Smiles:
COc1cc(C(=O)O)c(cc1[N+](=O)[O-])N
Complexity:
264
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.6
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-]
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-]
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
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
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
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
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.6