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88959-18-6 | 1-Cyclopentene-1-acetaldehyde, 2,4,4-trimethyl-
CAS No: 88959-18-6 Catalog No: AG0047SK MDL No:
Product Description
Catalog Number:
AG0047SK
Chemical Name:
1-Cyclopentene-1-acetaldehyde, 2,4,4-trimethyl-
CAS Number:
88959-18-6
Molecular Formula:
C10H16O
Molecular Weight:
152.2334
IUPAC Name:
2-(2,4,4-trimethylcyclopenten-1-yl)acetaldehyde
InChI:
InChI=1S/C10H16O/c1-8-6-10(2,3)7-9(8)4-5-11/h5H,4,6-7H2,1-3H3
InChI Key:
CTLUXRFRODQQRM-UHFFFAOYSA-N
SMILES:
O=CCC1=C(C)CC(C1)(C)C
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.12g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.237g/mol
Monoisotopic Mass:
152.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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