200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 162709-22-0
162709-22-0 | Carbamic acid, (4-formyl-2-methoxy-3-pyridinyl)-, 1,1-dimethylethyl ester (9CI)
CAS No: 162709-22-0 Catalog No: AG001TCV MDL No:MFCD10697545
Product Description
Catalog Number:
AG001TCV
Chemical Name:
Carbamic acid, (4-formyl-2-methoxy-3-pyridinyl)-, 1,1-dimethylethyl ester (9CI)
CAS Number:
162709-22-0
Molecular Formula:
C12H16N2O4
Molecular Weight:
252.2664
MDL Number:
MFCD10697545
IUPAC Name:
tert-butyl N-(4-formyl-2-methoxypyridin-3-yl)carbamate
InChI:
InChI=1S/C12H16N2O4/c1-12(2,3)18-11(16)14-9-8(7-15)5-6-13-10(9)17-4/h5-7H,1-4H3,(H,14,16)
InChI Key:
CSMRUMJMLVOJQE-UHFFFAOYSA-N
SMILES:
COc1nccc(c1NC(=O)OC(C)(C)C)C=O
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.111g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.27g/mol
Monoisotopic Mass:
252.111g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
77.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.