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6641-84-5 | 2-methoxyethyl 12-hydroxyoctadecanoate
CAS No: 6641-84-5 Catalog No: AG003HK2 MDL No:
Product Description
Catalog Number:
AG003HK2
Chemical Name:
2-methoxyethyl 12-hydroxyoctadecanoate
CAS Number:
6641-84-5
Molecular Formula:
C21H42O4
Molecular Weight:
358.5558
IUPAC Name:
2-methoxyethyl 12-hydroxyoctadecanoate
InChI:
InChI=1S/C21H42O4/c1-3-4-5-12-15-20(22)16-13-10-8-6-7-9-11-14-17-21(23)25-19-18-24-2/h20,22H,3-19H2,1-2H3
InChI Key:
LKTMQTARNSGNGM-UHFFFAOYSA-N
SMILES:
CCCCCCC(CCCCCCCCCCC(=O)OCCOC)O
NSC Number:
7398
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.308g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
358.563g/mol
Monoisotopic Mass:
358.308g/mol
Rotatable Bond Count:
20
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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