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81808-03-9 | 1,3-Cyclopentadiene, 5,5'-(1,3-propanediyl)bis-
CAS No: 81808-03-9 Catalog No: AG0056T6 MDL No:
Product Description
Catalog Number:
AG0056T6
Chemical Name:
1,3-Cyclopentadiene, 5,5'-(1,3-propanediyl)bis-
CAS Number:
81808-03-9
Molecular Formula:
C13H16
Molecular Weight:
172.2661
InChI:
InChI=1S/C13H16/c1-2-7-12(6-1)10-5-11-13-8-3-4-9-13/h1-4,6-9,12-13H,5,10-11H2
InChI Key:
AQAHYZBHLXLSHA-UHFFFAOYSA-N
SMILES:
C(CC1C=CC=C1)CC1C=CC=C1
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.125g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.271g/mol
Monoisotopic Mass:
172.125g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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