AB75010
57213-48-6 | L-3-Cyanophenylalanine
Manufacturer: A2B Chem
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CatalogNumber
AB75010
ChemicalName
L-3-Cyanophenylalanine
CasNumber
57213-48-6
MolecularFormula
C10H10N2O2
MolecularWeight
190.1986
MdlNumber
MFCD01860885
Smiles
N#Cc1cccc(c1)C[C@@H](C(=O)O)N
Complexity
256
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
-1.8
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CatalogNumber: AB75010
ChemicalName: L-3-Cyanophenylalanine
CasNumber: 57213-48-6
MolecularFormula: C10H10N2O2
MolecularWeight: 190.1986
MdlNumber: MFCD01860885
Smiles: N#Cc1cccc(c1)C[C@@H](C(=O)O)N
Complexity: 256
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: -1.8
CatalogNumber:
AB75010
ChemicalName:
L-3-Cyanophenylalanine
CasNumber:
57213-48-6
MolecularFormula:
C10H10N2O2
MolecularWeight:
190.1986
MdlNumber:
MFCD01860885
Smiles:
N#Cc1cccc(c1)C[C@@H](C(=O)O)N
Complexity:
256
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
-1.8
CatalogNumber: __
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Smiles: N#Cc1ccc(cc1)Cn1cncc1CN1CCN(C(=O)C1)c1cccc(c1)Cl.Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
N#Cc1ccc(cc1)Cn1cncc1CN1CCN(C(=O)C1)c1cccc(c1)Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__
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Smiles: CN[C@H](C(=O)O)Cc1c[nH]c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
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HydrogenBondDonorCount: __
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Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CN[C@H](C(=O)O)Cc1c[nH]c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(C(=O)O)Cc1ccc(c(c1)c1c(O)c(O)c2c(c1O)C(=O)c1c(C2=O)cc(c(c1C(=O)O)C(=O)O)O)O.Oc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(C)c(c(c1)O)C(=O)O.CC(=O)NCCc1ccc(c(c1)c1c(O)c(O)c2c(c1O)C(=O)c1c(C2=O)cc(c(c1C(=O)O)C(=O)O)O)O.OCCc1ccc(c(c1)c1c(O)c2c(c(c1O)O)C(=O)c1c(C2=O)c(C(=O)O)c(c(c1)O)C(=O)O)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
NC(C(=O)O)Cc1ccc(c(c1)c1c(O)c(O)c2c(c1O)C(=O)c1c(C2=O)cc(c(c1C(=O)O)C(=O)O)O)O.Oc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(C)c(c(c1)O)C(=O)O.CC(=O)NCCc1ccc(c(c1)c1c(O)c(O)c2c(c1O)C(=O)c1c(C2=O)cc(c(c1C(=O)O)C(=O)O)O)O.OCCc1ccc(c(c1)c1c(O)c2c(c(c1O)O)C(=O)c1c(C2=O)c(C(=O)O)c(c(c1)O)C(=O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__