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113548-17-7 | Benzene, [(1-cyclopenten-1-yloxy)methyl]-
CAS No: 113548-17-7 Catalog No: AG0008YD MDL No:
Product Description
Catalog Number:
AG0008YD
Chemical Name:
Benzene, [(1-cyclopenten-1-yloxy)methyl]-
CAS Number:
113548-17-7
Molecular Formula:
C12H14O
Molecular Weight:
174.2390
IUPAC Name:
cyclopenten-1-yloxymethylbenzene
InChI:
InChI=1S/C12H14O/c1-2-6-11(7-3-1)10-13-12-8-4-5-9-12/h1-3,6-8H,4-5,9-10H2
InChI Key:
DUHFMDXDADIOIZ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)COC1=CCCC1
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.104g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.243g/mol
Monoisotopic Mass:
174.104g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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