Home Other Building Blocks 2-ethyl-2-methylbut-3-enoic acid

2-ethyl-2-methylbut-3-enoic acid

CAS No.:
133900-65-9
Catalog Number:
AG019TFC
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
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Product Description
Catalog Number:
AG019TFC
Chemical Name:
2-ethyl-2-methylbut-3-enoic acid
CAS Number:
133900-65-9
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
MDL Number:
MFCD19229154
IUPAC Name:
2-ethyl-2-methylbut-3-enoic acid
InChI:
InChI=1S/C7H12O2/c1-4-7(3,5-2)6(8)9/h4H,1,5H2,2-3H3,(H,8,9)
InChI Key:
GLMCSCIKQIWYCQ-UHFFFAOYSA-N
SMILES:
CC(C(=O)O)(C=C)CC
Properties
Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.084g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
128.171g/mol
Monoisotopic Mass:
128.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties