AB51429
103877-80-1 | 2,5-Difluoro-4-methylbenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB51429
ChemicalName
2,5-Difluoro-4-methylbenzoic acid
CasNumber
103877-80-1
MolecularFormula
C8H6F2O2
MolecularWeight
172.1288
MdlNumber
MFCD00078261
Smiles
Fc1cc(C(=O)O)c(cc1C)F
Complexity
184
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AB51429
ChemicalName: 2,5-Difluoro-4-methylbenzoic acid
CasNumber: 103877-80-1
MolecularFormula: C8H6F2O2
MolecularWeight: 172.1288
MdlNumber: MFCD00078261
Smiles: Fc1cc(C(=O)O)c(cc1C)F
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AB51429
ChemicalName:
2,5-Difluoro-4-methylbenzoic acid
CasNumber:
103877-80-1
MolecularFormula:
C8H6F2O2
MolecularWeight:
172.1288
MdlNumber:
MFCD00078261
Smiles:
Fc1cc(C(=O)O)c(cc1C)F
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: AB51430
ChemicalName: 5-Chloro-2,4-dihydroxypyridine
CasNumber: 103766-25-2
MolecularFormula: C5H4ClNO2
MolecularWeight: 145.5438
MdlNumber: MFCD08458352
Smiles: Oc1ncc(c(c1)O)Cl
Complexity: 207
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: __
Xlogp3: -0.1
CatalogNumber:
AB51430
ChemicalName:
5-Chloro-2,4-dihydroxypyridine
CasNumber:
103766-25-2
MolecularFormula:
C5H4ClNO2
MolecularWeight:
145.5438
MdlNumber:
MFCD08458352
Smiles:
Oc1ncc(c(c1)O)Cl
Complexity:
207
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
__
Xlogp3:
-0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1n[nH]c2c1c(Cl)ccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1n[nH]c2c1c(Cl)ccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)Br
Complexity: 77
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)Br
Complexity:
77
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.8