Home Other Building Blocks Methyl (2E)-3,4,4-trimethylpent-2-enoate

Methyl (2E)-3,4,4-trimethylpent-2-enoate

CAS No.:
16466-25-4
Catalog Number:
AG00AQJQ
Molecular Formula:
C9H16O2
Molecular Weight:
156.2221
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$188
- +
5g
98%
In Stock USA
United States
$700
- +
Product Description
Catalog Number:
AG00AQJQ
Chemical Name:
Methyl (2E)-3,4,4-trimethylpent-2-enoate
CAS Number:
16466-25-4
Molecular Formula:
C9H16O2
Molecular Weight:
156.2221
MDL Number:
MFCD22586690
IUPAC Name:
methyl (E)-3,4,4-trimethylpent-2-enoate
InChI:
InChI=1S/C9H16O2/c1-7(9(2,3)4)6-8(10)11-5/h6H,1-5H3/b7-6+
InChI Key:
UNEGESGXUGUEAS-VOTSOKGWSA-N
SMILES:
COC(=O)/C=C(/C(C)(C)C)\C
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
156.115g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.225g/mol
Monoisotopic Mass:
156.115g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties