200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 124529-64-2
124529-64-2 | Carbamic acid, [6-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)hexyl]-, 1,1-dimethylethyl ester (9CI)
CAS No: 124529-64-2 Catalog No: AG000M6J MDL No:
Product Description
Catalog Number:
AG000M6J
Chemical Name:
Carbamic acid, [6-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)hexyl]-, 1,1-dimethylethyl ester (9CI)
CAS Number:
124529-64-2
Molecular Formula:
C15H24N2O4
Molecular Weight:
296.3621
IUPAC Name:
tert-butyl N-[6-(2,5-dioxopyrrol-1-yl)hexyl]carbamate
InChI:
InChI=1S/C15H24N2O4/c1-15(2,3)21-14(20)16-10-6-4-5-7-11-17-12(18)8-9-13(17)19/h8-9H,4-7,10-11H2,1-3H3,(H,16,20)
InChI Key:
HITIWLKYYJATIN-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCCCCCCN1C(=O)C=CC1=O
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.174g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
296.367g/mol
Monoisotopic Mass:
296.174g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
75.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.