AI60583
90537-46-5 | 2-Chloro-4-methoxy-5-nitro-benzoic acid methyl ester
Manufacturer: A2B Chem
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CatalogNumber
AI60583
ChemicalName
2-Chloro-4-methoxy-5-nitro-benzoic acid methyl ester
CasNumber
90537-46-5
MolecularFormula
C9H8ClNO5
MolecularWeight
245.61652
MdlNumber
MFCD26396226
Smiles
COC(=O)c1cc([N+](=O)[O-])c(cc1Cl)OC
Complexity
280
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
RotatableBondCount
3
Xlogp3
2.2
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CatalogNumber: AI60583
ChemicalName: 2-Chloro-4-methoxy-5-nitro-benzoic acid methyl ester
CasNumber: 90537-46-5
MolecularFormula: C9H8ClNO5
MolecularWeight: 245.61652
MdlNumber: MFCD26396226
Smiles: COC(=O)c1cc([N+](=O)[O-])c(cc1Cl)OC
Complexity: 280
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 2.2
CatalogNumber:
AI60583
ChemicalName:
2-Chloro-4-methoxy-5-nitro-benzoic acid methyl ester
CasNumber:
90537-46-5
MolecularFormula:
C9H8ClNO5
MolecularWeight:
245.61652
MdlNumber:
MFCD26396226
Smiles:
COC(=O)c1cc([N+](=O)[O-])c(cc1Cl)OC
Complexity:
280
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(c(c1O)OC)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
COc1ccc(c(c1O)OC)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)NC(=O)c1c(F)cccc1F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
COc1ccc(cc1)NC(=O)c1c(F)cccc1F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Ic1cnc(c(c1)[N+](=O)[O-])C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Ic1cnc(c(c1)[N+](=O)[O-])C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__