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1217830-91-5 | Pentanoic acid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-3-hydroxy-, (3R)-
CAS No: 1217830-91-5 Catalog No: AG0015ZO MDL No:
Product Description
Catalog Number:
AG0015ZO
Chemical Name:
Pentanoic acid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-3-hydroxy-, (3R)-
CAS Number:
1217830-91-5
Molecular Formula:
C10H19NO5
Molecular Weight:
233.2616
IUPAC Name:
(3R)-3-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
InChI:
InChI=1S/C10H19NO5/c1-10(2,3)16-9(15)11-5-4-7(12)6-8(13)14/h7,12H,4-6H2,1-3H3,(H,11,15)(H,13,14)/t7-/m1/s1
InChI Key:
VHZWCUURDLLIRJ-SSDOTTSWSA-N
SMILES:
O[C@@H](CC(=O)O)CCNC(=O)OC(C)(C)C
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
233.126g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
233.264g/mol
Monoisotopic Mass:
233.126g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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