Home Other Building Blocks Undecanedioic acid,1-methyl ester

Undecanedioic acid,1-methyl ester

CAS No.:
3927-60-4
Catalog Number:
AG0037HY
Molecular Formula:
C12H22O4
Molecular Weight:
230.3007
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Product Description
Catalog Number:
AG0037HY
Chemical Name:
Undecanedioic acid,1-methyl ester
CAS Number:
3927-60-4
Molecular Formula:
C12H22O4
Molecular Weight:
230.3007
MDL Number:
MFCD00673464
IUPAC Name:
11-methoxy-11-oxoundecanoic acid
InChI:
InChI=1S/C12H22O4/c1-16-12(15)10-8-6-4-2-3-5-7-9-11(13)14/h2-10H2,1H3,(H,13,14)
InChI Key:
JAELIPKEGUQPKD-UHFFFAOYSA-N
SMILES:
COC(=O)CCCCCCCCCC(=O)O
NSC Number:
38783
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.152g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.304g/mol
Monoisotopic Mass:
230.152g/mol
Rotatable Bond Count:
11  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties