Home Other Building Blocks Octanedioic acid, 1-(1,1-dimethylethyl) 8-methyl ester

Octanedioic acid, 1-(1,1-dimethylethyl) 8-methyl ester

CAS No.:
137299-08-2
Catalog Number:
AG00132G
Molecular Formula:
C13H24O4
Molecular Weight:
244.3273
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$216
- +
5g
97%
1 week
United States
$573
- +
Product Description
Catalog Number:
AG00132G
Chemical Name:
Octanedioic acid, 1-(1,1-dimethylethyl) 8-methyl ester
CAS Number:
137299-08-2
Molecular Formula:
C13H24O4
Molecular Weight:
244.3273
MDL Number:
MFCD31718292
IUPAC Name:
8-O-tert-butyl 1-O-methyl octanedioate
InChI:
InChI=1S/C13H24O4/c1-13(2,3)17-12(15)10-8-6-5-7-9-11(14)16-4/h5-10H2,1-4H3
InChI Key:
AVMXBOOJSVOCFZ-UHFFFAOYSA-N
SMILES:
COC(=O)CCCCCCC(=O)OC(C)(C)C
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.167g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.331g/mol
Monoisotopic Mass:
244.167g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties