AI08982
112251-93-1 | 3-Chloro-4-methyl-2-nitrophenol
Manufacturer: A2B Chem
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CatalogNumber
AI08982
ChemicalName
3-Chloro-4-methyl-2-nitrophenol
CasNumber
112251-93-1
MolecularFormula
C7H6ClNO3
MolecularWeight
187.5804
MdlNumber
MFCD28096627
Smiles
[O-][N+](=O)c1c(O)ccc(c1Cl)C
Complexity
182
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
Xlogp3
2.9
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CatalogNumber: AI08982
ChemicalName: 3-Chloro-4-methyl-2-nitrophenol
CasNumber: 112251-93-1
MolecularFormula: C7H6ClNO3
MolecularWeight: 187.5804
MdlNumber: MFCD28096627
Smiles: [O-][N+](=O)c1c(O)ccc(c1Cl)C
Complexity: 182
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
Xlogp3: 2.9
CatalogNumber:
AI08982
ChemicalName:
3-Chloro-4-methyl-2-nitrophenol
CasNumber:
112251-93-1
MolecularFormula:
C7H6ClNO3
MolecularWeight:
187.5804
MdlNumber:
MFCD28096627
Smiles:
[O-][N+](=O)c1c(O)ccc(c1Cl)C
Complexity:
182
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
Xlogp3:
2.9
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Smiles: NNC(=O)CNc1ccccc1OC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
NNC(=O)CNc1ccccc1OC
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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Xlogp3:
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Smiles: OC(C1CCCC1)C#C
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MolecularFormula:
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Smiles:
OC(C1CCCC1)C#C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
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Smiles: O=C(N1CC(C1)NC(=O)OC(C)(C)C)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CC(C1)NC(=O)OC(C)(C)C)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__