AB03474
202001-00-1 | 3-Chloro-5-fluorophenylacetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB03474
ChemicalName
3-Chloro-5-fluorophenylacetic acid
CasNumber
202001-00-1
MolecularFormula
C8H6ClFO2
MolecularWeight
188.5834
MdlNumber
MFCD03788475
Smiles
OC(=O)Cc1cc(F)cc(c1)Cl
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AB03474
ChemicalName: 3-Chloro-5-fluorophenylacetic acid
CasNumber: 202001-00-1
MolecularFormula: C8H6ClFO2
MolecularWeight: 188.5834
MdlNumber: MFCD03788475
Smiles: OC(=O)Cc1cc(F)cc(c1)Cl
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AB03474
ChemicalName:
3-Chloro-5-fluorophenylacetic acid
CasNumber:
202001-00-1
MolecularFormula:
C8H6ClFO2
MolecularWeight:
188.5834
MdlNumber:
MFCD03788475
Smiles:
OC(=O)Cc1cc(F)cc(c1)Cl
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: AB03475
ChemicalName: 3-Bromo-5-fluorophenylacetic acid
CasNumber: 202000-99-5
MolecularFormula: C8H6BrFO2
MolecularWeight: 233.0344432
MdlNumber: MFCD09258961
Smiles: OC(=O)Cc1cc(F)cc(c1)Br
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.2
CatalogNumber:
AB03475
ChemicalName:
3-Bromo-5-fluorophenylacetic acid
CasNumber:
202000-99-5
MolecularFormula:
C8H6BrFO2
MolecularWeight:
233.0344432
MdlNumber:
MFCD09258961
Smiles:
OC(=O)Cc1cc(F)cc(c1)Br
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(C[C@@H](C(=O)Nc1ccc2c(c1)cccc2)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CCC(=O)O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(C[C@@H](C(=O)Nc1ccc2c(c1)cccc2)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CCC(=O)O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB03478
ChemicalName: 2-Chloro-4-nitro-benzenesulfonyl chloride
CasNumber: 20201-03-0
MolecularFormula: C6H3Cl2NO4S
MolecularWeight: 256.0633
MdlNumber: MFCD03954008
Smiles: Clc1cc(ccc1S(=O)(=O)Cl)[N+](=O)[O-]
Complexity: 320
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.4
CatalogNumber:
AB03478
ChemicalName:
2-Chloro-4-nitro-benzenesulfonyl chloride
CasNumber:
20201-03-0
MolecularFormula:
C6H3Cl2NO4S
MolecularWeight:
256.0633
MdlNumber:
MFCD03954008
Smiles:
Clc1cc(ccc1S(=O)(=O)Cl)[N+](=O)[O-]
Complexity:
320
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.4