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7774-82-5 | trans-2-tridecen-1-al
CAS No: 7774-82-5 Catalog No: AG003UWT MDL No:
Product Description
Catalog Number:
AG003UWT
Chemical Name:
trans-2-tridecen-1-al
CAS Number:
7774-82-5
Molecular Formula:
C13H24O
Molecular Weight:
196.3291
IUPAC Name:
(E)-tridec-2-enal
InChI:
InChI=1S/C13H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h11-13H,2-10H2,1H3/b12-11+
InChI Key:
VMUNAKQXJLHODT-VAWYXSNFSA-N
SMILES:
CCCCCCCCCC/C=C/C=O
UNII:
C950P0MYML
NSC Number:
617616
FEMA Number:
3082
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
196.183g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.334g/mol
Monoisotopic Mass:
196.183g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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