AI64003
952-04-5 | 1-Chloro-3-(3-nitrophenyl)benzene
Manufacturer: A2B Chem
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CatalogNumber
AI64003
ChemicalName
1-Chloro-3-(3-nitrophenyl)benzene
CasNumber
952-04-5
MolecularFormula
C12H8ClNO2
MolecularWeight
233.6504
MdlNumber
MFCD21332976
Smiles
Clc1cccc(c1)c1cccc(c1)[N+](=O)[O-]
Complexity
254
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
4.5
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CatalogNumber: AI64003
ChemicalName: 1-Chloro-3-(3-nitrophenyl)benzene
CasNumber: 952-04-5
MolecularFormula: C12H8ClNO2
MolecularWeight: 233.6504
MdlNumber: MFCD21332976
Smiles: Clc1cccc(c1)c1cccc(c1)[N+](=O)[O-]
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 4.5
CatalogNumber:
AI64003
ChemicalName:
1-Chloro-3-(3-nitrophenyl)benzene
CasNumber:
952-04-5
MolecularFormula:
C12H8ClNO2
MolecularWeight:
233.6504
MdlNumber:
MFCD21332976
Smiles:
Clc1cccc(c1)c1cccc(c1)[N+](=O)[O-]
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
4.5
CatalogNumber: AI64004
ChemicalName: 1-Chloro-3-(4-nitrophenyl)benzene
CasNumber: 952-22-7
MolecularFormula: C12H8ClNO2
MolecularWeight: 233.6504
MdlNumber: MFCD20529491
Smiles: Clc1cccc(c1)c1ccc(cc1)[N+](=O)[O-]
Complexity: 246
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 4.4
CatalogNumber:
AI64004
ChemicalName:
1-Chloro-3-(4-nitrophenyl)benzene
CasNumber:
952-22-7
MolecularFormula:
C12H8ClNO2
MolecularWeight:
233.6504
MdlNumber:
MFCD20529491
Smiles:
Clc1cccc(c1)c1ccc(cc1)[N+](=O)[O-]
Complexity:
246
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
4.4
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MolecularFormula: __
MolecularWeight: __
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Smiles: O[C@@H]1C[C@H](C1)CNC(=O)OC(C)(C)C
Complexity: __
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Smiles:
O[C@@H]1C[C@H](C1)CNC(=O)OC(C)(C)C
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HydrogenBondAcceptorCount:
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Smiles: COc1ncc2c(c1)c(Cl)ccn2
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Smiles:
COc1ncc2c(c1)c(Cl)ccn2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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