Home Carbonyls D-Valine, N-(methoxycarbonyl)-, methyl ester

D-Valine, N-(methoxycarbonyl)-, methyl ester

CAS No.:
153575-98-5
Catalog Number:
AG00ABNO
Molecular Formula:
C8H15NO4
Molecular Weight:
189.2090
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Product Description
Catalog Number:
AG00ABNO
Chemical Name:
D-Valine, N-(methoxycarbonyl)-, methyl ester
CAS Number:
153575-98-5
Molecular Formula:
C8H15NO4
Molecular Weight:
189.2090
MDL Number:
MFCD28402939
IUPAC Name:
methyl (2R)-2-(methoxycarbonylamino)-3-methylbutanoate
InChI:
InChI=1S/C8H15NO4/c1-5(2)6(7(10)12-3)9-8(11)13-4/h5-6H,1-4H3,(H,9,11)/t6-/m1/s1
InChI Key:
QWGFBSMKDNXREL-ZCFIWIBFSA-N
SMILES:
COC(=O)N[C@@H](C(=O)OC)C(C)C
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
189.1g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.211g/mol
Monoisotopic Mass:
189.1g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties