AC63692
741721-49-3 | 2,5-Difluoro-3-nitrobenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AC63692
ChemicalName
2,5-Difluoro-3-nitrobenzoic acid
CasNumber
741721-49-3
MolecularFormula
C7H3F2NO4
MolecularWeight
203.0998
MdlNumber
MFCD11848537
Smiles
Fc1cc([N+](=O)[O-])c(c(c1)C(=O)O)F
Complexity
255
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.5
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CatalogNumber: AC63692
ChemicalName: 2,5-Difluoro-3-nitrobenzoic acid
CasNumber: 741721-49-3
MolecularFormula: C7H3F2NO4
MolecularWeight: 203.0998
MdlNumber: MFCD11848537
Smiles: Fc1cc([N+](=O)[O-])c(c(c1)C(=O)O)F
Complexity: 255
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AC63692
ChemicalName:
2,5-Difluoro-3-nitrobenzoic acid
CasNumber:
741721-49-3
MolecularFormula:
C7H3F2NO4
MolecularWeight:
203.0998
MdlNumber:
MFCD11848537
Smiles:
Fc1cc([N+](=O)[O-])c(c(c1)C(=O)O)F
Complexity:
255
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: AC63693
ChemicalName: 2,3-Dichloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
CasNumber: 741709-64-8
MolecularFormula: C11H14BCl2NO2
MolecularWeight: 273.95136
MdlNumber: MFCD08063093
Smiles: Clc1ncc(cc1Cl)B1OC(C(O1)(C)C)(C)C
Complexity: 285
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AC63693
ChemicalName:
2,3-Dichloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
CasNumber:
741709-64-8
MolecularFormula:
C11H14BCl2NO2
MolecularWeight:
273.95136
MdlNumber:
MFCD08063093
Smiles:
Clc1ncc(cc1Cl)B1OC(C(O1)(C)C)(C)C
Complexity:
285
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCC/C=C/CCCCCCCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCCCC/C=C/CCCCCCCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCS(=O)(=O)c1ccc(cc1)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCS(=O)(=O)c1ccc(cc1)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__