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144610-97-9 | 7-Tetradecen-3-ol, acetate, (Z)- (9CI)
CAS No: 144610-97-9 Catalog No: AG001JUX MDL No:
Product Description
Catalog Number:
AG001JUX
Chemical Name:
7-Tetradecen-3-ol, acetate, (Z)- (9CI)
CAS Number:
144610-97-9
Molecular Formula:
C16H30O2
Molecular Weight:
254.4082
IUPAC Name:
acetic acid;tetradec-7-en-3-ol
InChI:
InChI=1S/C14H28O.C2H4O2/c1-3-5-6-7-8-9-10-11-12-13-14(15)4-2;1-2(3)4/h9-10,14-15H,3-8,11-13H2,1-2H3;1H3,(H,3,4)
InChI Key:
AUBPXMNIYHVOOT-UHFFFAOYSA-N
SMILES:
CCCCCC/C=C\CCCC(OC(=O)C)CC
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.235g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
272.429g/mol
Monoisotopic Mass:
272.235g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
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