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88544-74-5 | Cyclohexene, [1-(bromomethyl)-3-butenyl]-
CAS No: 88544-74-5 Catalog No: AG004FQI MDL No:
Product Description
Catalog Number:
AG004FQI
Chemical Name:
Cyclohexene, [1-(bromomethyl)-3-butenyl]-
CAS Number:
88544-74-5
Molecular Formula:
C11H17Br
Molecular Weight:
229.1567
IUPAC Name:
1-(1-bromopent-4-en-2-yl)cyclohexene
InChI:
InChI=1S/C11H17Br/c1-2-6-11(9-12)10-7-4-3-5-8-10/h2,7,11H,1,3-6,8-9H2
InChI Key:
MNJSLJOTNVOKCK-UHFFFAOYSA-N
SMILES:
C=CCC(C1=CCCCC1)CBr
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.051g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.161g/mol
Monoisotopic Mass:
228.051g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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