200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 89319-56-2
89319-56-2 | Benzenecarboperoxoic acid, 1-methylethyl ester
CAS No: 89319-56-2 Catalog No: AG003YIB MDL No:
Product Description
Catalog Number:
AG003YIB
Chemical Name:
Benzenecarboperoxoic acid, 1-methylethyl ester
CAS Number:
89319-56-2
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
IUPAC Name:
propan-2-yl benzenecarboperoxoate
InChI:
InChI=1S/C10H12O3/c1-8(2)12-13-10(11)9-6-4-3-5-7-9/h3-8H,1-2H3
InChI Key:
BWVDUDRBWILROL-UHFFFAOYSA-N
SMILES:
CC(OOC(=O)c1ccccc1)C
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.203g/mol
Monoisotopic Mass:
180.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.