AC86096
99585-14-5 | 2-Chloro-6-methyl-benzoic acid methyl ester
Manufacturer: A2B Chem
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CatalogNumber
AC86096
ChemicalName
2-Chloro-6-methyl-benzoic acid methyl ester
CasNumber
99585-14-5
MolecularFormula
C9H9ClO2
MolecularWeight
184.6196
MdlNumber
MFCD06204147
Smiles
COC(=O)c1c(C)cccc1Cl
Complexity
170
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
2.6
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CatalogNumber: AC86096
ChemicalName: 2-Chloro-6-methyl-benzoic acid methyl ester
CasNumber: 99585-14-5
MolecularFormula: C9H9ClO2
MolecularWeight: 184.6196
MdlNumber: MFCD06204147
Smiles: COC(=O)c1c(C)cccc1Cl
Complexity: 170
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2.6
CatalogNumber:
AC86096
ChemicalName:
2-Chloro-6-methyl-benzoic acid methyl ester
CasNumber:
99585-14-5
MolecularFormula:
C9H9ClO2
MolecularWeight:
184.6196
MdlNumber:
MFCD06204147
Smiles:
COC(=O)c1c(C)cccc1Cl
Complexity:
170
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2.6
CatalogNumber: AC86097
ChemicalName: 3-Chloro-4-ethoxybenzaldehyde
CasNumber: 99585-10-1
MolecularFormula: C9H9ClO2
MolecularWeight: 184.6196
MdlNumber: MFCD06246171
Smiles: CCOc1ccc(cc1Cl)C=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AC86097
ChemicalName:
3-Chloro-4-ethoxybenzaldehyde
CasNumber:
99585-10-1
MolecularFormula:
C9H9ClO2
MolecularWeight:
184.6196
MdlNumber:
MFCD06246171
Smiles:
CCOc1ccc(cc1Cl)C=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCc1ccnc(c1)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCCc1ccnc(c1)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1cc2nccnc2cc1N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1cc2nccnc2cc1N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__