AI64105
95262-10-5 | 3-((4-Fluorophenyl)amino)-3-oxopropanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI64105
ChemicalName
3-((4-Fluorophenyl)amino)-3-oxopropanoic acid
CasNumber
95262-10-5
MolecularFormula
C9H8FNO3
MolecularWeight
197.16312320000006
MdlNumber
MFCD00201972
Smiles
O=C(Nc1ccc(cc1)F)CC(=O)O
Complexity
224
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
1.7
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CatalogNumber: AI64105
ChemicalName: 3-((4-Fluorophenyl)amino)-3-oxopropanoic acid
CasNumber: 95262-10-5
MolecularFormula: C9H8FNO3
MolecularWeight: 197.16312320000006
MdlNumber: MFCD00201972
Smiles: O=C(Nc1ccc(cc1)F)CC(=O)O
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 1.7
CatalogNumber:
AI64105
ChemicalName:
3-((4-Fluorophenyl)amino)-3-oxopropanoic acid
CasNumber:
95262-10-5
MolecularFormula:
C9H8FNO3
MolecularWeight:
197.16312320000006
MdlNumber:
MFCD00201972
Smiles:
O=C(Nc1ccc(cc1)F)CC(=O)O
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cc2c([nH]1)cc(cc2C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cc2c([nH]1)cc(cc2C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI64107
ChemicalName: (R)-3-Aminopentanoic acid hydrochloride
CasNumber: 952650-02-1
MolecularFormula: C5H12ClNO2
MolecularWeight: 153.6073
MdlNumber: MFCD08702981
Smiles: CC[C@H](CC(=O)O)N.Cl
Complexity: 82.5
Covalently-bondedUnitCount: 2
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AI64107
ChemicalName:
(R)-3-Aminopentanoic acid hydrochloride
CasNumber:
952650-02-1
MolecularFormula:
C5H12ClNO2
MolecularWeight:
153.6073
MdlNumber:
MFCD08702981
Smiles:
CC[C@H](CC(=O)O)N.Cl
Complexity:
82.5
Covalently-bondedUnitCount:
2
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)N3C=C(C(=O)NC3=O)F)F)OC(=O)C4=CC=CC=C4
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)N3C=C(C(=O)NC3=O)F)F)OC(=O)C4=CC=CC=C4
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__