AB50272
14316-06-4 | D-Alanine methyl ester, HCl
Manufacturer: A2B Chem
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CatalogNumber
AB50272
ChemicalName
D-Alanine methyl ester, HCl
CasNumber
14316-06-4
MolecularFormula
C4H10ClNO2
MolecularWeight
139.5807
MdlNumber
MFCD00066141
Smiles
COC(=O)[C@H](N)C.Cl
Complexity
72.1
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
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CatalogNumber: AB50272
ChemicalName: D-Alanine methyl ester, HCl
CasNumber: 14316-06-4
MolecularFormula: C4H10ClNO2
MolecularWeight: 139.5807
MdlNumber: MFCD00066141
Smiles: COC(=O)[C@H](N)C.Cl
Complexity: 72.1
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AB50272
ChemicalName:
D-Alanine methyl ester, HCl
CasNumber:
14316-06-4
MolecularFormula:
C4H10ClNO2
MolecularWeight:
139.5807
MdlNumber:
MFCD00066141
Smiles:
COC(=O)[C@H](N)C.Cl
Complexity:
72.1
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc2-c3c(Cc2c1)cccc3
Complexity: 208
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1ccc2-c3c(Cc2c1)cccc3
Complexity:
208
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[N+](CC1OC1)(C)C.[Cl-]
Complexity: 85
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[N+](CC1OC1)(C)C.[Cl-]
Complexity:
85
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCNc1cc(cc(c1Oc1ccccc1)S(=O)(=O)N)C(=O)O
Complexity: 528
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCNc1cc(cc(c1Oc1ccccc1)S(=O)(=O)N)C(=O)O
Complexity:
528
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__