AB45993
5619-07-8 | DL-phenylalanine methyl ester, HCl
Manufacturer: A2B Chem
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CatalogNumber
AB45993
ChemicalName
DL-phenylalanine methyl ester, HCl
CasNumber
5619-07-8
MolecularFormula
C10H14ClNO2
MolecularWeight
215.67666
MdlNumber
MFCD00066113
Smiles
COC(=O)C(Cc1ccccc1)N.Cl
NscNumber
194642
Complexity
164
Covalently-bondedUnitCount
2
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
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CatalogNumber: AB45993
ChemicalName: DL-phenylalanine methyl ester, HCl
CasNumber: 5619-07-8
MolecularFormula: C10H14ClNO2
MolecularWeight: 215.67666
MdlNumber: MFCD00066113
Smiles: COC(=O)C(Cc1ccccc1)N.Cl
NscNumber: 194642
Complexity: 164
Covalently-bondedUnitCount: 2
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AB45993
ChemicalName:
DL-phenylalanine methyl ester, HCl
CasNumber:
5619-07-8
MolecularFormula:
C10H14ClNO2
MolecularWeight:
215.67666
MdlNumber:
MFCD00066113
Smiles:
COC(=O)C(Cc1ccccc1)N.Cl
NscNumber:
194642
Complexity:
164
Covalently-bondedUnitCount:
2
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[C@H]([C@@H](C(=O)O)N)O
NscNumber: __
Complexity: 93.3
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[C@H]([C@@H](C(=O)O)N)O
NscNumber:
__
Complexity:
93.3
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C(C(C)C)N.Cl
NscNumber: __
Complexity: 112
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C(C(C)C)N.Cl
NscNumber:
__
Complexity:
112
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: AB45996
ChemicalName: 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-ol
CasNumber: 10191-41-0
MolecularFormula: C29H50O2
MolecularWeight: 430.7061
MdlNumber: MFCD00072045
Smiles: CC(CCCC1(C)CCc2c(O1)c(C)c(c(c2C)O)C)CCCC(CCCC(C)C)C
NscNumber: __
Complexity: 503
Covalently-bondedUnitCount: 1
HeavyAtomCount: 31
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 12
UndefinedAtomStereocenterCount: 3
CatalogNumber:
AB45996
ChemicalName:
2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-ol
CasNumber:
10191-41-0
MolecularFormula:
C29H50O2
MolecularWeight:
430.7061
MdlNumber:
MFCD00072045
Smiles:
CC(CCCC1(C)CCc2c(O1)c(C)c(c(c2C)O)C)CCCC(CCCC(C)C)C
NscNumber:
__
Complexity:
503
Covalently-bondedUnitCount:
1
HeavyAtomCount:
31
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
12
UndefinedAtomStereocenterCount:
3