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29343-60-0 | 2-Dodecenal, 4-hydroxy-
CAS No: 29343-60-0 Catalog No: AG002Y4G MDL No:
Product Description
Catalog Number:
AG002Y4G
Chemical Name:
2-Dodecenal, 4-hydroxy-
CAS Number:
29343-60-0
Molecular Formula:
C12H22O2
Molecular Weight:
198.3019
IUPAC Name:
(E)-4-hydroxydodec-2-enal
InChI:
InChI=1S/C12H22O2/c1-2-3-4-5-6-7-9-12(14)10-8-11-13/h8,10-12,14H,2-7,9H2,1H3/b10-8+
InChI Key:
ZEHVTBHDQIECNE-CSKARUKUSA-N
SMILES:
CCCCCCCCC(C=CC=O)O
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
198.162g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.306g/mol
Monoisotopic Mass:
198.162g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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