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H-D-Leu-OMe·HCl

CAT: 0607-A6752-25000Size: 25 gDry Ice: NoHazardous: No
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CAT#:0607-A6752-25000Size:25 g
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CAS Number
5845-53-4
Product Name Alternative
methyl (2R)-2-amino-4-methylpentanoate;hydrochloride
Purity
0.98
Smiles
CC(C)CC(C(=O)OC)N.Cl
Molecular Formula
C7H16ClNO2
Molecular Weight
181.66
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

D-Leucine Methyl Ester Hydrochloride
CAS Number5845-53-4
PubChem CID11600782
IUPAC Namemethyl (2R)-2-amino-4-methylpentanoate;hydrochloride
Molecular FormulaC7H16ClNO2
Molecular Weight181.66
Topological Polar Surface Area52.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count11
Formal Charge0
Complexity112
SMILES
CC(C)C[C@H](C(=O)OC)N.Cl
InChI
InChI=1S/C7H15NO2.ClH/c1-5(2)4-6(8)7(9)10-3;/h5-6H,4,8H2,1-3H3;1H/t6-;/m1./s1
InChIKey
DODCBMODXGJOKD-FYZOBXCZSA-N
Chemical Structure
2D Structure
2D structure of D-Leucine Methyl Ester Hydrochloride
CAS: 5845-53-4
CID: 11600782
Formula: C7H16ClNO2
MW: 181.66
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight181.66
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass181.0869564
Monoisotopic Mass181.0869564
Topological Polar Surface Area52.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity112
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