Home Other Building Blocks tert-butyl N-[2-(2-methylpropyl)-3-oxopropyl]carbamate

tert-butyl N-[2-(2-methylpropyl)-3-oxopropyl]carbamate

CAS No.:
1780318-36-6
Catalog Number:
AG01DYW4
Molecular Formula:
C12H23NO3
Molecular Weight:
229.3159
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Product Description
Catalog Number:
AG01DYW4
Chemical Name:
tert-butyl N-[2-(2-methylpropyl)-3-oxopropyl]carbamate
CAS Number:
1780318-36-6
Molecular Formula:
C12H23NO3
Molecular Weight:
229.3159
MDL Number:
MFCD28544042
IUPAC Name:
tert-butyl N-(2-formyl-4-methylpentyl)carbamate
InChI:
InChI=1S/C12H23NO3/c1-9(2)6-10(8-14)7-13-11(15)16-12(3,4)5/h8-10H,6-7H2,1-5H3,(H,13,15)
InChI Key:
DORQCCNLYAGUSQ-UHFFFAOYSA-N
SMILES:
O=CC(CC(C)C)CNC(=O)OC(C)(C)C
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.168g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.32g/mol
Monoisotopic Mass:
229.168g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties