AC35440
79477-86-4 | 2-(2-Fluorophenyl)-2-oxoacetic acid
Manufacturer: A2B Chem
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CatalogNumber
AC35440
ChemicalName
2-(2-Fluorophenyl)-2-oxoacetic acid
CasNumber
79477-86-4
MolecularFormula
C8H5FO3
MolecularWeight
168.1219
MdlNumber
MFCD06739153
Smiles
OC(=O)C(=O)c1ccccc1F
Complexity
203
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.7
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CatalogNumber: AC35440
ChemicalName: 2-(2-Fluorophenyl)-2-oxoacetic acid
CasNumber: 79477-86-4
MolecularFormula: C8H5FO3
MolecularWeight: 168.1219
MdlNumber: MFCD06739153
Smiles: OC(=O)C(=O)c1ccccc1F
Complexity: 203
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AC35440
ChemicalName:
2-(2-Fluorophenyl)-2-oxoacetic acid
CasNumber:
79477-86-4
MolecularFormula:
C8H5FO3
MolecularWeight:
168.1219
MdlNumber:
MFCD06739153
Smiles:
OC(=O)C(=O)c1ccccc1F
Complexity:
203
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN(C=Cc1c(cccc1[N+](=O)[O-])[N+](=O)[O-])C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN(C=Cc1c(cccc1[N+](=O)[O-])[N+](=O)[O-])C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AC35445
ChemicalName: 2-Amino-3-bromo-5-trifluoromethylpyridine
CasNumber: 79456-30-7
MolecularFormula: C6H4BrF3N2
MolecularWeight: 241.00856959999993
MdlNumber: MFCD07375382
Smiles: Nc1ncc(cc1Br)C(F)(F)F
Complexity: 161
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 2.1
CatalogNumber:
AC35445
ChemicalName:
2-Amino-3-bromo-5-trifluoromethylpyridine
CasNumber:
79456-30-7
MolecularFormula:
C6H4BrF3N2
MolecularWeight:
241.00856959999993
MdlNumber:
MFCD07375382
Smiles:
Nc1ncc(cc1Br)C(F)(F)F
Complexity:
161
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc(c(c1)C)OCc1[nH][nH]c(=S)n1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc(c(c1)C)OCc1[nH][nH]c(=S)n1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__