200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 179104-42-8
179104-42-8 | 1,3-Cyclohexadiene-1-carbonyl chloride, 4,6,6-trimethyl-
CAS No: 179104-42-8 Catalog No: AG0026SU MDL No:
Product Description
Catalog Number:
AG0026SU
Chemical Name:
1,3-Cyclohexadiene-1-carbonyl chloride, 4,6,6-trimethyl-
CAS Number:
179104-42-8
Molecular Formula:
C10H13ClO
Molecular Weight:
184.6626
IUPAC Name:
4,6,6-trimethylcyclohexa-1,3-diene-1-carbonyl chloride
InChI:
InChI=1S/C10H13ClO/c1-7-4-5-8(9(11)12)10(2,3)6-7/h4-5H,6H2,1-3H3
InChI Key:
HGKHQFHUXCJYMP-UHFFFAOYSA-N
SMILES:
ClC(=O)C1=CC=C(CC1(C)C)C
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.065g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.663g/mol
Monoisotopic Mass:
184.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^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.