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1314964-37-8 | 2-Chloro-5-[2-(1,3-dioxanyl)]-1-pentene
CAS No: 1314964-37-8 Catalog No: AG01FCBB MDL No:
Product Description
Catalog Number:
AG01FCBB
Chemical Name:
2-Chloro-5-[2-(1,3-dioxanyl)]-1-pentene
CAS Number:
1314964-37-8
Molecular Formula:
C9H15ClO2
Molecular Weight:
190.6672
IUPAC Name:
2-(4-chloropent-4-enyl)-1,3-dioxane
InChI:
InChI=1S/C9H15ClO2/c1-8(10)4-2-5-9-11-6-3-7-12-9/h9H,1-7H2
InChI Key:
OASQFLNOWUGMLU-UHFFFAOYSA-N
SMILES:
ClC(=C)CCCC1OCCCO1
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.076g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.667g/mol
Monoisotopic Mass:
190.076g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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