AE93365
170902-74-6 | (S)-Methyl 2-amino-2-(4-fluorophenyl)acetate
Manufacturer: A2B Chem
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CatalogNumber
AE93365
ChemicalName
(S)-Methyl 2-amino-2-(4-fluorophenyl)acetate
CasNumber
170902-74-6
MolecularFormula
C9H10FNO2
MolecularWeight
183.1796
MdlNumber
MFCD08704819
Smiles
COC(=O)[C@H](c1ccc(cc1)F)N
Complexity
179
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1
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CatalogNumber: AE93365
ChemicalName: (S)-Methyl 2-amino-2-(4-fluorophenyl)acetate
CasNumber: 170902-74-6
MolecularFormula: C9H10FNO2
MolecularWeight: 183.1796
MdlNumber: MFCD08704819
Smiles: COC(=O)[C@H](c1ccc(cc1)F)N
Complexity: 179
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1
CatalogNumber:
AE93365
ChemicalName:
(S)-Methyl 2-amino-2-(4-fluorophenyl)acetate
CasNumber:
170902-74-6
MolecularFormula:
C9H10FNO2
MolecularWeight:
183.1796
MdlNumber:
MFCD08704819
Smiles:
COC(=O)[C@H](c1ccc(cc1)F)N
Complexity:
179
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1
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Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1c(cccc1C(C)C)C(C)C
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Smiles:
Cc1ccc(cc1)S(=O)(=O)Nc1c(cccc1C(C)C)C(C)C
Complexity:
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Smiles: CCCCCC(=O)C=CC1C(CC2C1CC(=O)O2)OC(=O)C3=CC=CC=C3
Complexity: __
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Xlogp3: __
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MolecularWeight:
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Smiles:
CCCCCC(=O)C=CC1C(CC2C1CC(=O)O2)OC(=O)C3=CC=CC=C3
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__