200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1001-88-3
1001-88-3 | 1,6-Heptadien-3-yne, 2-methyl-
CAS No: 1001-88-3 Catalog No: AG0000XV MDL No:
Product Description
Catalog Number:
AG0000XV
Chemical Name:
1,6-Heptadien-3-yne, 2-methyl-
CAS Number:
1001-88-3
Molecular Formula:
C8H10
Molecular Weight:
106.1650
IUPAC Name:
2-methylhepta-1,6-dien-3-yne
InChI:
InChI=1S/C8H10/c1-4-5-6-7-8(2)3/h4H,1-2,5H2,3H3
InChI Key:
JDSRPIAZFIFPGF-UHFFFAOYSA-N
SMILES:
C=CCC#CC(=C)C
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
106.078g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
106.168g/mol
Monoisotopic Mass:
106.078g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.