Home Other Building Blocks 2-METHYL-2-(OXOLAN-2-YL)PROPANOIC ACID

2-METHYL-2-(OXOLAN-2-YL)PROPANOIC ACID

CAS No.:
1378809-45-0
Catalog Number:
AG01BI6H
Molecular Formula:
C8H14O3
Molecular Weight:
158.1950
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Product Description
Catalog Number:
AG01BI6H
Chemical Name:
2-METHYL-2-(OXOLAN-2-YL)PROPANOIC ACID
CAS Number:
1378809-45-0
Molecular Formula:
C8H14O3
Molecular Weight:
158.1950
MDL Number:
MFCD20656980
IUPAC Name:
2-methyl-2-(oxolan-2-yl)propanoic acid
InChI:
InChI=1S/C8H14O3/c1-8(2,7(9)10)6-4-3-5-11-6/h6H,3-5H2,1-2H3,(H,9,10)
InChI Key:
WZMOEYCPWHIRPE-UHFFFAOYSA-N
SMILES:
OC(=O)C(C1CCCO1)(C)C
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.094g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
158.197g/mol
Monoisotopic Mass:
158.094g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties