200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 111080-65-0
111080-65-0 | tert-Butyl (pyridin-4-ylmethyl);carbamate
CAS No: 111080-65-0 Catalog No: AG003K6F MDL No:MFCD01321573
Product Description
Catalog Number:
AG003K6F
Chemical Name:
tert-Butyl (pyridin-4-ylmethyl);carbamate
CAS Number:
111080-65-0
Molecular Formula:
C11H16N2O2
Molecular Weight:
208.2569
MDL Number:
MFCD01321573
IUPAC Name:
tert-butyl N-(pyridin-4-ylmethyl)carbamate
InChI:
InChI=1S/C11H16N2O2/c1-11(2,3)15-10(14)13-8-9-4-6-12-7-5-9/h4-7H,8H2,1-3H3,(H,13,14)
InChI Key:
KXCFJDZVQLRYSI-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCc1ccncc1
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.121g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.261g/mol
Monoisotopic Mass:
208.121g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
© 2019 Angene International Limited. All rights Reserved.