AB47547
59483-54-4 | 3-Chloro-2-nitroaniline
Manufacturer: A2B Chem
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CatalogNumber
AB47547
ChemicalName
3-Chloro-2-nitroaniline
CasNumber
59483-54-4
MolecularFormula
C6H5ClN2O2
MolecularWeight
172.5691
MdlNumber
MFCD01317803
Smiles
[O-][N+](=O)c1c(N)cccc1Cl
Complexity
159
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
Xlogp3
2.2
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CatalogNumber: AB47547
ChemicalName: 3-Chloro-2-nitroaniline
CasNumber: 59483-54-4
MolecularFormula: C6H5ClN2O2
MolecularWeight: 172.5691
MdlNumber: MFCD01317803
Smiles: [O-][N+](=O)c1c(N)cccc1Cl
Complexity: 159
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
Xlogp3: 2.2
CatalogNumber:
AB47547
ChemicalName:
3-Chloro-2-nitroaniline
CasNumber:
59483-54-4
MolecularFormula:
C6H5ClN2O2
MolecularWeight:
172.5691
MdlNumber:
MFCD01317803
Smiles:
[O-][N+](=O)c1c(N)cccc1Cl
Complexity:
159
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc2ccc(cc2cc1OC)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc2ccc(cc2cc1OC)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C([C@H](Cc1ccc(cc1)OC(C)(C)C)N)OC(C)(C)C.Cl
Complexity: 333
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C([C@H](Cc1ccc(cc1)OC(C)(C)C)N)OC(C)(C)C.Cl
Complexity:
333
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: AB47550
ChemicalName: Pyrazine-2,6-dicarboxylic acid
CasNumber: 940-07-8
MolecularFormula: C6H4N2O4
MolecularWeight: 168.107
MdlNumber: MFCD08694102
Smiles: OC(=O)c1cncc(n1)C(=O)O
Complexity: 186
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
Xlogp3: -0.5
CatalogNumber:
AB47550
ChemicalName:
Pyrazine-2,6-dicarboxylic acid
CasNumber:
940-07-8
MolecularFormula:
C6H4N2O4
MolecularWeight:
168.107
MdlNumber:
MFCD08694102
Smiles:
OC(=O)c1cncc(n1)C(=O)O
Complexity:
186
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
Xlogp3:
-0.5