200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 16387-55-6
16387-55-6 | 2-Octyne, 1,1-diethoxy-
CAS No: 16387-55-6 Catalog No: AG001UH0 MDL No:
Product Description
Catalog Number:
AG001UH0
Chemical Name:
2-Octyne, 1,1-diethoxy-
CAS Number:
16387-55-6
Molecular Formula:
C12H22O2
Molecular Weight:
198.3019
IUPAC Name:
1,1-diethoxyoct-2-yne
InChI:
InChI=1S/C12H22O2/c1-4-7-8-9-10-11-12(13-5-2)14-6-3/h12H,4-9H2,1-3H3
InChI Key:
YKXAYRBNHIHDSI-UHFFFAOYSA-N
SMILES:
CCCCCC#CC(OCC)OCC
EC Number:
240-438-1
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.162g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.306g/mol
Monoisotopic Mass:
198.162g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.