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178152-48-2

178152-48-2 | Carbamic acid, N-[(1R,4S)-4-hydroxy-2-cyclopenten-1-yl]-, 1,1-dimethylethyl ester, rel-

CAS No: 178152-48-2 Catalog No: AG0025SF MDL No:MFCD09954747

Product Description

Catalog Number:
AG0025SF
Chemical Name:
Carbamic acid, N-[(1R,4S)-4-hydroxy-2-cyclopenten-1-yl]-, 1,1-dimethylethyl ester, rel-
CAS Number:
178152-48-2
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
MDL Number:
MFCD09954747
IUPAC Name:
tert-butyl N-[(1R,4S)-4-hydroxycyclopent-2-en-1-yl]carbamate
InChI:
InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-7-4-5-8(12)6-7/h4-5,7-8,12H,6H2,1-3H3,(H,11,13)/t7-,8+/m0/s1
InChI Key:
UWWUTEZECIYOCW-JGVFFNPUSA-N
SMILES:
O[C@@H]1C=C[C@@H](C1)NC(=O)OC(C)(C)C

Properties

Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
199.121g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
199.25g/mol
Monoisotopic Mass:
199.121g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

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