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D-Valine methyl ester hydrochloride

CAT: 0862-GM9253-5gSize: 5 gDry Ice: NoHazardous: No
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CAT#:0862-GM9253-5gSize:5 g
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CAS Number
7146-15-8
EC Number
230-454-7
MDL Number
MFCD00237309
Molecular Formula
C6H13NO2HCl
Molecular Weight
167.64
Hazardous Class
Not hazardous

Chemical Information

Methyl D-valinate hydrochloride
CAS Number7146-15-8
PubChem CID11984198
IUPAC Namemethyl (2R)-2-amino-3-methylbutanoate;hydrochloride
Molecular FormulaC6H14ClNO2
Molecular Weight167.63
Topological Polar Surface Area52.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count10
Formal Charge0
Complexity101
SMILES
CC(C)[C@H](C(=O)OC)N.Cl
InChI
InChI=1S/C6H13NO2.ClH/c1-4(2)5(7)6(8)9-3;/h4-5H,7H2,1-3H3;1H/t5-;/m1./s1
InChIKey
KUGLDBMQKZTXPW-NUBCRITNSA-N
Chemical Structure
2D Structure
2D structure of Methyl D-valinate hydrochloride
CAS: 7146-15-8
CID: 11984198
Formula: C6H14ClNO2
MW: 167.63
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight167.63
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass167.0713064
Monoisotopic Mass167.0713064
Topological Polar Surface Area52.3 Ų
Heavy Atom Count10
Formal Charge0
Complexity101
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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