AA14701
1160573-19-2 | 4-Chloro-3,5-difluorobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA14701
ChemicalName
4-Chloro-3,5-difluorobenzoic acid
CasNumber
1160573-19-2
MolecularFormula
C7H3ClF2O2
MolecularWeight
192.5473
MdlNumber
MFCD11554154
Smiles
OC(=O)c1cc(F)c(c(c1)F)Cl
Complexity
176
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.3
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CatalogNumber: AA14701
ChemicalName: 4-Chloro-3,5-difluorobenzoic acid
CasNumber: 1160573-19-2
MolecularFormula: C7H3ClF2O2
MolecularWeight: 192.5473
MdlNumber: MFCD11554154
Smiles: OC(=O)c1cc(F)c(c(c1)F)Cl
Complexity: 176
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AA14701
ChemicalName:
4-Chloro-3,5-difluorobenzoic acid
CasNumber:
1160573-19-2
MolecularFormula:
C7H3ClF2O2
MolecularWeight:
192.5473
MdlNumber:
MFCD11554154
Smiles:
OC(=O)c1cc(F)c(c(c1)F)Cl
Complexity:
176
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1c(F)cc(cc1F)I
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1c(F)cc(cc1F)I
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA14703
ChemicalName: 3-Chloro-5-(trifluoromethyl)phenylboronic acid
CasNumber: 1160561-31-8
MolecularFormula: C7H5BClF3O2
MolecularWeight: 224.3726
MdlNumber: MFCD07778020
Smiles: Clc1cc(cc(c1)C(F)(F)F)B(O)O
Complexity: 200
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AA14703
ChemicalName:
3-Chloro-5-(trifluoromethyl)phenylboronic acid
CasNumber:
1160561-31-8
MolecularFormula:
C7H5BClF3O2
MolecularWeight:
224.3726
MdlNumber:
MFCD07778020
Smiles:
Clc1cc(cc(c1)C(F)(F)F)B(O)O
Complexity:
200
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OB(c1c(C)cc(cc1C)Br)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OB(c1c(C)cc(cc1C)Br)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__