AA90169
167993-21-7 | Boc-2-(trifluoromethyl)-L-phenylalanine
Manufacturer: A2B Chem
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CatalogNumber
AA90169
ChemicalName
Boc-2-(trifluoromethyl)-L-phenylalanine
CasNumber
167993-21-7
MolecularFormula
C15H18F3NO4
MolecularWeight
333.3029
MdlNumber
MFCD01862946
Smiles
O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1ccccc1C(F)(F)F
Complexity
431
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
6
Xlogp3
3.4
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CatalogNumber: AA90169
ChemicalName: Boc-2-(trifluoromethyl)-L-phenylalanine
CasNumber: 167993-21-7
MolecularFormula: C15H18F3NO4
MolecularWeight: 333.3029
MdlNumber: MFCD01862946
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1ccccc1C(F)(F)F
Complexity: 431
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 6
Xlogp3: 3.4
CatalogNumber:
AA90169
ChemicalName:
Boc-2-(trifluoromethyl)-L-phenylalanine
CasNumber:
167993-21-7
MolecularFormula:
C15H18F3NO4
MolecularWeight:
333.3029
MdlNumber:
MFCD01862946
Smiles:
O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1ccccc1C(F)(F)F
Complexity:
431
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
6
Xlogp3:
3.4
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Smiles: O=C1OC(=O)c2c1cc1[nH]cnc1c2
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Smiles:
O=C1OC(=O)c2c1cc1[nH]cnc1c2
Complexity:
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Covalently-bondedUnitCount:
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DefinedAtomStereocenterCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
MolecularWeight: __
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Smiles: O=C([C@H](Cc1cccc(c1)F)N)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C([C@H](Cc1cccc(c1)F)N)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@H](Cc1c(F)cccc1F)NC(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@H](Cc1c(F)cccc1F)NC(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__