200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 30711-32-1
30711-32-1 | 2-Heptyn-1-one, 1-(2-thienyl)-
CAS No: 30711-32-1 Catalog No: AG00311P MDL No:
Product Description
Catalog Number:
AG00311P
Chemical Name:
2-Heptyn-1-one, 1-(2-thienyl)-
CAS Number:
30711-32-1
Molecular Formula:
C11H12OS
Molecular Weight:
192.2774
IUPAC Name:
1-thiophen-2-ylhept-2-yn-1-one
InChI:
InChI=1S/C11H12OS/c1-2-3-4-5-7-10(12)11-8-6-9-13-11/h6,8-9H,2-4H2,1H3
InChI Key:
IOYDEGVHQQIFKD-UHFFFAOYSA-N
SMILES:
CCCCC#CC(=O)c1cccs1
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.061g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.276g/mol
Monoisotopic Mass:
192.061g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.