Home Other Building Blocks Methyl olivetolate

Methyl olivetolate

CAS No.:
58016-28-7
Catalog Number:
AG00JNSD
Molecular Formula:
C13H18O4
Molecular Weight:
238.2796
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00JNSD
Chemical Name:
Methyl olivetolate
CAS Number:
58016-28-7
Molecular Formula:
C13H18O4
Molecular Weight:
238.2796
MDL Number:
MFCD06737776
IUPAC Name:
methyl 2,4-dihydroxy-6-pentylbenzoate
InChI:
InChI=1S/C13H18O4/c1-3-4-5-6-9-7-10(14)8-11(15)12(9)13(16)17-2/h7-8,14-15H,3-6H2,1-2H3
InChI Key:
RQGAOBDPFOADCM-UHFFFAOYSA-N
SMILES:
CCCCCc1cc(O)cc(c1C(=O)OC)O
EC Number:
810-693-9
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.121g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
238.283g/mol
Monoisotopic Mass:
238.121g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Literature
Title Journal
Activities of 2,4-dihydroxy-6-n-pentylbenzoic acid derivatives. Zeitschrift fur Naturforschung. C, Journal of biosciences 20080101
Properties