200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 207804-97-5
207804-97-5 | 1H-2-Benzopyran, 3,4-dihydro-6-nitro-
CAS No: 207804-97-5 Catalog No: AG002JB5 MDL No:MFCD08234693
Product Description
Catalog Number:
AG002JB5
Chemical Name:
1H-2-Benzopyran, 3,4-dihydro-6-nitro-
CAS Number:
207804-97-5
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
MDL Number:
MFCD08234693
IUPAC Name:
6-nitro-3,4-dihydro-1H-isochromene
InChI:
InChI=1S/C9H9NO3/c11-10(12)9-2-1-8-6-13-4-3-7(8)5-9/h1-2,5H,3-4,6H2
InChI Key:
RTBMEWOVRPAVMS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)CCOC2
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.175g/mol
Monoisotopic Mass:
179.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.