AA07291
1018678-48-2 | 2-Difluoromethyl-benzoic acid methyl ester
Manufacturer: A2B Chem
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CatalogNumber
AA07291
ChemicalName
2-Difluoromethyl-benzoic acid methyl ester
CasNumber
1018678-48-2
MolecularFormula
C9H8F2O2
MolecularWeight
186.1554
MdlNumber
MFCD16140192
Smiles
COC(=O)c1ccccc1C(F)F
Complexity
183
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
3
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CatalogNumber: AA07291
ChemicalName: 2-Difluoromethyl-benzoic acid methyl ester
CasNumber: 1018678-48-2
MolecularFormula: C9H8F2O2
MolecularWeight: 186.1554
MdlNumber: MFCD16140192
Smiles: COC(=O)c1ccccc1C(F)F
Complexity: 183
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AA07291
ChemicalName:
2-Difluoromethyl-benzoic acid methyl ester
CasNumber:
1018678-48-2
MolecularFormula:
C9H8F2O2
MolecularWeight:
186.1554
MdlNumber:
MFCD16140192
Smiles:
COC(=O)c1ccccc1C(F)F
Complexity:
183
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
3
CatalogNumber: AA07292
ChemicalName: 4-Chloro-2-(trifluoromethyl)nicotinic acid
CasNumber: 1018678-39-1
MolecularFormula: C7H3ClF3NO2
MolecularWeight: 225.5524
MdlNumber: MFCD22546902
Smiles: OC(=O)c1c(Cl)ccnc1C(F)(F)F
Complexity: 234
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AA07292
ChemicalName:
4-Chloro-2-(trifluoromethyl)nicotinic acid
CasNumber:
1018678-39-1
MolecularFormula:
C7H3ClF3NO2
MolecularWeight:
225.5524
MdlNumber:
MFCD22546902
Smiles:
OC(=O)c1c(Cl)ccnc1C(F)(F)F
Complexity:
234
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
RotatableBondCount:
1
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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MdlNumber: __
Smiles: OC(=O)c1c(N)ccnc1Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)c1c(N)ccnc1Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1c(N)ccnc1Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1c(N)ccnc1Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__