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25489-02-5

25489-02-5 | 1-methoxybicyclo[2.2.2]oct-2-ene

CAS No: 25489-02-5 Catalog No: AG006U4B MDL No:

Product Description

Catalog Number:
AG006U4B
Chemical Name:
1-methoxybicyclo[2.2.2]oct-2-ene
CAS Number:
25489-02-5
Molecular Formula:
C9H14O
Molecular Weight:
138.2069
IUPAC Name:
1-methoxybicyclo[2.2.2]oct-2-ene
InChI:
InChI=1S/C9H14O/c1-10-9-5-2-8(3-6-9)4-7-9/h2,5,8H,3-4,6-7H2,1H3
InChI Key:
FWPZEMDZGYCLDY-UHFFFAOYSA-N
SMILES:
COC12CCC(CC1)C=C2

Properties

Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.104g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.21g/mol
Monoisotopic Mass:
138.104g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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