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84477-15-6

84477-15-6 | 2-Nonenoic acid, 4-hydroxy-, methyl ester, (2E)-

CAS No: 84477-15-6 Catalog No: AG004W1N MDL No:

Product Description

Catalog Number:
AG004W1N
Chemical Name:
2-Nonenoic acid, 4-hydroxy-, methyl ester, (2E)-
CAS Number:
84477-15-6
Molecular Formula:
C10H18O3
Molecular Weight:
186.2481
IUPAC Name:
methyl 4-hydroxynon-2-enoate
InChI:
InChI=1S/C10H18O3/c1-3-4-5-6-9(11)7-8-10(12)13-2/h7-9,11H,3-6H2,1-2H3
InChI Key:
KHWJRDOTQVENHO-UHFFFAOYSA-N
SMILES:
CCCCCC(/C=C/C(=O)OC)O

Properties

Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.126g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.251g/mol
Monoisotopic Mass:
186.126g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.1  

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