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92235-34-2 | (S)-tert-Butyl (2-oxopyrrolidin-3-yl)carbamate
CAS No: 92235-34-2 Catalog No: AG0036Q1 MDL No:MFCD03426144
Product Description
Catalog Number:
AG0036Q1
Chemical Name:
(S)-tert-Butyl (2-oxopyrrolidin-3-yl)carbamate
CAS Number:
92235-34-2
Molecular Formula:
C9H16N2O3
Molecular Weight:
200.2349
MDL Number:
MFCD03426144
IUPAC Name:
tert-butyl N-[(3S)-2-oxopyrrolidin-3-yl]carbamate
InChI:
InChI=1S/C9H16N2O3/c1-9(2,3)14-8(13)11-6-4-5-10-7(6)12/h6H,4-5H2,1-3H3,(H,10,12)(H,11,13)/t6-/m0/s1
InChI Key:
DVWCHAUBYVZILO-LURJTMIESA-N
SMILES:
O=C(OC(C)(C)C)N[C@H]1CCNC1=O
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
200.116g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.238g/mol
Monoisotopic Mass:
200.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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