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Home > Other Heterocycles > 959704-59-7
959704-59-7 | tert-butyl 1-oxaspiro[2.5]octan-6-ylcarbamate
CAS No: 959704-59-7 Catalog No: AG01DKCV MDL No:MFCD22377855
Product Description
Catalog Number:
AG01DKCV
Chemical Name:
tert-butyl 1-oxaspiro[2.5]octan-6-ylcarbamate
CAS Number:
959704-59-7
Molecular Formula:
C12H21NO3
Molecular Weight:
227.3000
MDL Number:
MFCD22377855
IUPAC Name:
tert-butyl N-(1-oxaspiro[2.5]octan-6-yl)carbamate
InChI:
InChI=1S/C12H21NO3/c1-11(2,3)16-10(14)13-9-4-6-12(7-5-9)8-15-12/h9H,4-8H2,1-3H3,(H,13,14)
InChI Key:
FSVLLSRKSDMUDC-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CCC2(CC1)OC2
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.152g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.304g/mol
Monoisotopic Mass:
227.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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