200,000+ products from a single source!
sales@angenechem.com
791009-51-3 | 1,4-Benzodioxin-5-carboxylicacid, 6-amino-2,3-dihydro-
CAS No: 791009-51-3 Catalog No: AG0053V1 MDL No:
Product Description
Catalog Number:
AG0053V1
Chemical Name:
1,4-Benzodioxin-5-carboxylicacid, 6-amino-2,3-dihydro-
CAS Number:
791009-51-3
Molecular Formula:
C9H9NO4
Molecular Weight:
195.1721
IUPAC Name:
6-amino-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid
InChI:
InChI=1S/C9H9NO4/c10-5-1-2-6-8(7(5)9(11)12)14-4-3-13-6/h1-2H,3-4,10H2,(H,11,12)
InChI Key:
PDUIYXZLRIYDTB-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(N)ccc2c1OCCO2
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.053g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
195.174g/mol
Monoisotopic Mass:
195.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.