AX25001
86129-35-3 | Methyl 2-((tert-butoxycarbonyl)amino)-3-(4-fluorophenyl)propanoate
Manufacturer: A2B Chem
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CatalogNumber
AX25001
ChemicalName
Methyl 2-((tert-butoxycarbonyl)amino)-3-(4-fluorophenyl)propanoate
CasNumber
86129-35-3
MolecularFormula
C15H20FNO4
MolecularWeight
297.322
MdlNumber
MFCD24473468
Smiles
COC(=O)C(Cc1ccc(cc1)F)NC(=O)OC(C)(C)C
Complexity
359
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
7
UndefinedAtomStereocenterCount
1
Xlogp3
2.2
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CatalogNumber: AX25001
ChemicalName: Methyl 2-((tert-butoxycarbonyl)amino)-3-(4-fluorophenyl)propanoate
CasNumber: 86129-35-3
MolecularFormula: C15H20FNO4
MolecularWeight: 297.322
MdlNumber: MFCD24473468
Smiles: COC(=O)C(Cc1ccc(cc1)F)NC(=O)OC(C)(C)C
Complexity: 359
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 7
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.2
CatalogNumber:
AX25001
ChemicalName:
Methyl 2-((tert-butoxycarbonyl)amino)-3-(4-fluorophenyl)propanoate
CasNumber:
86129-35-3
MolecularFormula:
C15H20FNO4
MolecularWeight:
297.322
MdlNumber:
MFCD24473468
Smiles:
COC(=O)C(Cc1ccc(cc1)F)NC(=O)OC(C)(C)C
Complexity:
359
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
7
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.2
CatalogNumber: AX25002
ChemicalName: (S)-3-(4-Fluorophenyl)morpholine hydrochloride
CasNumber: 1391469-10-5
MolecularFormula: C10H13ClFNO
MolecularWeight: 217.6677
MdlNumber: MFCD12910637
Smiles: Fc1ccc(cc1)[C@@H]1NCCOC1.Cl
Complexity: 157
Covalently-bondedUnitCount: 2
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AX25002
ChemicalName:
(S)-3-(4-Fluorophenyl)morpholine hydrochloride
CasNumber:
1391469-10-5
MolecularFormula:
C10H13ClFNO
MolecularWeight:
217.6677
MdlNumber:
MFCD12910637
Smiles:
Fc1ccc(cc1)[C@@H]1NCCOC1.Cl
Complexity:
157
Covalently-bondedUnitCount:
2
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccccc1[C@H]1CCCN1.Cl
Complexity: 149
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccccc1[C@H]1CCCN1.Cl
Complexity:
149
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN[C@H](c1ccccc1Cl)C.Cl
Complexity: 116
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN[C@H](c1ccccc1Cl)C.Cl
Complexity:
116
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__