Home Other Building Blocks tert-butyl N-(3,3-dimethyl-5-oxocyclohexyl)carbamate

tert-butyl N-(3,3-dimethyl-5-oxocyclohexyl)carbamate

CAS No.:
1989672-47-0
Catalog Number:
AG01B2DJ
Molecular Formula:
C13H23NO3
Molecular Weight:
241.3266
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Product Description
Catalog Number:
AG01B2DJ
Chemical Name:
tert-butyl N-(3,3-dimethyl-5-oxocyclohexyl)carbamate
CAS Number:
1989672-47-0
Molecular Formula:
C13H23NO3
Molecular Weight:
241.3266
MDL Number:
MFCD30342745
IUPAC Name:
tert-butyl N-(3,3-dimethyl-5-oxocyclohexyl)carbamate
InChI:
InChI=1S/C13H23NO3/c1-12(2,3)17-11(16)14-9-6-10(15)8-13(4,5)7-9/h9H,6-8H2,1-5H3,(H,14,16)
InChI Key:
UNBAMXRPPJFULU-UHFFFAOYSA-N
SMILES:
O=C1CC(NC(=O)OC(C)(C)C)CC(C1)(C)C
Properties
Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.168g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.331g/mol
Monoisotopic Mass:
241.168g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties