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119859-31-3 | 1,3-Cyclopentadiene, 1-(3-buten-1-yl)-2,3,4,5-tetramethyl-
CAS No: 119859-31-3 Catalog No: AG000PSZ MDL No:
Product Description
Catalog Number:
AG000PSZ
Chemical Name:
1,3-Cyclopentadiene, 1-(3-buten-1-yl)-2,3,4,5-tetramethyl-
CAS Number:
119859-31-3
Molecular Formula:
C13H20
Molecular Weight:
176.2979
InChI:
InChI=1S/C13H20/c1-6-7-8-13-11(4)9(2)10(3)12(13)5/h6,11H,1,7-8H2,2-5H3
InChI Key:
OYQXZNMTNZIEHJ-UHFFFAOYSA-N
SMILES:
C=CCCC1=C(C)C(=C(C1C)C)C
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.157g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.303g/mol
Monoisotopic Mass:
176.157g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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