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1189-09-9 | METHYL GERANATE
CAS No: 1189-09-9 Catalog No: AG003S0A MDL No:
Product Description
Catalog Number:
AG003S0A
Chemical Name:
METHYL GERANATE
CAS Number:
1189-09-9
IUPAC Name:
methyl (2E)-3,7-dimethylocta-2,6-dienoate
InChI:
InChI=1S/C11H18O2/c1-9(2)6-5-7-10(3)8-11(12)13-4/h6,8H,5,7H2,1-4H3/b10-8+
InChI Key:
ACOBBFVLNKYODD-CSKARUKUSA-N
EC Number:
214-712-6
UNII:
26YR95MGP2
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
182.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.263g/mol
Monoisotopic Mass:
182.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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