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85178-58-1 | 4-Nonenoic acid, 9-chloro-, methyl ester, (Z)-
CAS No: 85178-58-1 Catalog No: AG004QO9 MDL No:
Product Description
Catalog Number:
AG004QO9
Chemical Name:
4-Nonenoic acid, 9-chloro-, methyl ester, (Z)-
CAS Number:
85178-58-1
Molecular Formula:
C10H17ClO2
Molecular Weight:
204.6938
IUPAC Name:
methyl 9-chloronon-4-enoate
InChI:
InChI=1S/C10H17ClO2/c1-13-10(12)8-6-4-2-3-5-7-9-11/h2,4H,3,5-9H2,1H3
InChI Key:
LVQRZQSBAYEUFD-UHFFFAOYSA-N
SMILES:
ClCCCC/C=C\CCC(=O)OC
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.092g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.694g/mol
Monoisotopic Mass:
204.092g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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