200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 130089-39-3
130089-39-3 | 1H-2-Benzopyran, 1-(1-methylethyl)-
CAS No: 130089-39-3 Catalog No: AG000TZR MDL No:MFCD18807173
Product Description
Catalog Number:
AG000TZR
Chemical Name:
1H-2-Benzopyran, 1-(1-methylethyl)-
CAS Number:
130089-39-3
Molecular Formula:
C12H14O
Molecular Weight:
174.2390
MDL Number:
MFCD18807173
IUPAC Name:
1-propan-2-yl-1H-isochromene
InChI:
InChI=1S/C12H14O/c1-9(2)12-11-6-4-3-5-10(11)7-8-13-12/h3-9,12H,1-2H3
InChI Key:
SZIJFHJNEUTHHB-UHFFFAOYSA-N
SMILES:
CC(C1OC=Cc2c1cccc2)C
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.104g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.243g/mol
Monoisotopic Mass:
174.104g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.