200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1244949-11-8
1244949-11-8 | 2H-1,4-Benzoxazine-8-carbonitrile, 3,4-dihydro-, hydrochloride (1:1)
CAS No: 1244949-11-8 Catalog No: AG000M3M MDL No:MFCD09026852
Product Description
Catalog Number:
AG000M3M
Chemical Name:
2H-1,4-Benzoxazine-8-carbonitrile, 3,4-dihydro-, hydrochloride (1:1)
CAS Number:
1244949-11-8
Molecular Formula:
C9H9ClN2O
Molecular Weight:
196.6336
MDL Number:
MFCD09026852
IUPAC Name:
3,4-dihydro-2H-1,4-benzoxazine-8-carbonitrile;hydrochloride
InChI:
InChI=1S/C9H8N2O.ClH/c10-6-7-2-1-3-8-9(7)12-5-4-11-8;/h1-3,11H,4-5H2;1H
InChI Key:
CVIDZNUZVIQMSH-UHFFFAOYSA-N
SMILES:
N#Cc1cccc2c1OCCN2.Cl
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.04g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.634g/mol
Monoisotopic Mass:
196.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.