Home Other Building Blocks 2,2-dimethyl-3-(oxan-4-yl)propanoic acid

2,2-dimethyl-3-(oxan-4-yl)propanoic acid

CAS No.:
1262408-58-1
Catalog Number:
AG01A020
Molecular Formula:
C10H18O3
Molecular Weight:
186.2481
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Product Description
Catalog Number:
AG01A020
Chemical Name:
2,2-dimethyl-3-(oxan-4-yl)propanoic acid
CAS Number:
1262408-58-1
Molecular Formula:
C10H18O3
Molecular Weight:
186.2481
MDL Number:
MFCD16855556
IUPAC Name:
2,2-dimethyl-3-(oxan-4-yl)propanoic acid
InChI:
InChI=1S/C10H18O3/c1-10(2,9(11)12)7-8-3-5-13-6-4-8/h8H,3-7H2,1-2H3,(H,11,12)
InChI Key:
YTKCURONSSHPOB-UHFFFAOYSA-N
SMILES:
OC(=O)C(CC1CCOCC1)(C)C
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.126g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.251g/mol
Monoisotopic Mass:
186.126g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties