200,000+ products from a single source!

sales@angenechem.com

Home > Carboxes > 99849-17-9

99849-17-9

99849-17-9 | 8-CHLOROMETHYL-6-NITRO-4H-BENZO[1,3]DIOXINE

CAS No: 99849-17-9 Catalog No: AG003W73 MDL No:MFCD00173700

Product Description

Catalog Number:
AG003W73
Chemical Name:
8-CHLOROMETHYL-6-NITRO-4H-BENZO[1,3]DIOXINE
CAS Number:
99849-17-9
Molecular Formula:
C9H8ClNO4
Molecular Weight:
229.6171
MDL Number:
MFCD00173700
IUPAC Name:
8-(chloromethyl)-6-nitro-4H-1,3-benzodioxine
InChI:
InChI=1S/C9H8ClNO4/c10-3-6-1-8(11(12)13)2-7-4-14-5-15-9(6)7/h1-2H,3-5H2
InChI Key:
PSVFVAYNOKLOMR-UHFFFAOYSA-N
SMILES:
ClCc1cc(cc2c1OCOC2)[N+](=O)[O-]

Properties

Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.014g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.616g/mol
Monoisotopic Mass:
229.014g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

Related Products

© 2019 Angene International Limited. All rights Reserved.