AA83045
16118-36-8 | Methyl 2-amino-4-(methylthio)butanoate hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AA83045
ChemicalName
Methyl 2-amino-4-(methylthio)butanoate hydrochloride
CasNumber
16118-36-8
MolecularFormula
C6H14ClNO2S
MolecularWeight
199.6989
MdlNumber
MFCD00067540
Smiles
CSCC[C@@H](C(=O)OC)N.Cl
NscNumber
522231
Complexity
108
Covalently-bondedUnitCount
2
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
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CatalogNumber: AA83045
ChemicalName: Methyl 2-amino-4-(methylthio)butanoate hydrochloride
CasNumber: 16118-36-8
MolecularFormula: C6H14ClNO2S
MolecularWeight: 199.6989
MdlNumber: MFCD00067540
Smiles: CSCC[C@@H](C(=O)OC)N.Cl
NscNumber: 522231
Complexity: 108
Covalently-bondedUnitCount: 2
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AA83045
ChemicalName:
Methyl 2-amino-4-(methylthio)butanoate hydrochloride
CasNumber:
16118-36-8
MolecularFormula:
C6H14ClNO2S
MolecularWeight:
199.6989
MdlNumber:
MFCD00067540
Smiles:
CSCC[C@@H](C(=O)OC)N.Cl
NscNumber:
522231
Complexity:
108
Covalently-bondedUnitCount:
2
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
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Smiles: N=Cc1ccccc1
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N=Cc1ccccc1
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Smiles: O=C1NC(=O)N(C1)N=Cc1ccc(o1)c1cccc(c1)C(F)(F)F
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Smiles:
O=C1NC(=O)N(C1)N=Cc1ccc(o1)c1cccc(c1)C(F)(F)F
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Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1NC(=O)CN1N=Cc1ccc(o1)c1ccc(cc1)F
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1NC(=O)CN1N=Cc1ccc(o1)c1ccc(cc1)F
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__