Home Other Building Blocks 2,6,6-Trimethylcyclohepta-2,4-dienone

2,6,6-Trimethylcyclohepta-2,4-dienone

CAS No.:
503-93-5
Catalog Number:
AG003G1I
Molecular Formula:
C10H14O
Molecular Weight:
150.2176
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>96.0%(GC)
1 week
United States
$231
- +
Product Description
Catalog Number:
AG003G1I
Chemical Name:
2,6,6-Trimethylcyclohepta-2,4-dienone
CAS Number:
503-93-5
Molecular Formula:
C10H14O
Molecular Weight:
150.2176
MDL Number:
MFCD00182537
IUPAC Name:
2,6,6-trimethylcyclohepta-2,4-dien-1-one
InChI:
InChI=1S/C10H14O/c1-8-5-4-6-10(2,3)7-9(8)11/h4-6H,7H2,1-3H3
InChI Key:
QNGQIURXCUHNAT-UHFFFAOYSA-N
SMILES:
CC1=CC=CC(CC1=O)(C)C
UNII:
6H2K49X6B0
NSC Number:
127544
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.104g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.221g/mol
Monoisotopic Mass:
150.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties