Home Carbonyls Pentanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-, (3R)- (9CI)

Pentanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-, (3R)- (9CI)

CAS No.:
183990-60-5
Catalog Number:
AG00BATD
Molecular Formula:
C10H19NO4
Molecular Weight:
217.2622
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Product Description
Catalog Number:
AG00BATD
Chemical Name:
Pentanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-, (3R)- (9CI)
CAS Number:
183990-60-5
Molecular Formula:
C10H19NO4
Molecular Weight:
217.2622
MDL Number:
MFCD08166685
IUPAC Name:
3-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
InChI:
InChI=1S/C10H19NO4/c1-5-7(6-8(12)13)11-9(14)15-10(2,3)4/h7H,5-6H2,1-4H3,(H,11,14)(H,12,13)
InChI Key:
RJCHFHWEJSMOJW-UHFFFAOYSA-N
SMILES:
CC[C@@H](NC(=O)OC(C)(C)C)CC(=O)O
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.131g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
217.265g/mol
Monoisotopic Mass:
217.131g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties