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128845-83-0 | 2,4-Octadienoic acid, 8-azido-, ethyl ester, (2E,4E)-
CAS No: 128845-83-0 Catalog No: AG000YG5 MDL No:
Product Description
Catalog Number:
AG000YG5
Chemical Name:
2,4-Octadienoic acid, 8-azido-, ethyl ester, (2E,4E)-
CAS Number:
128845-83-0
Molecular Formula:
C10H15N3O2
Molecular Weight:
209.2450
IUPAC Name:
ethyl 8-azidoocta-2,4-dienoate
InChI:
InChI=1S/C10H15N3O2/c1-2-15-10(14)8-6-4-3-5-7-9-12-13-11/h3-4,6,8H,2,5,7,9H2,1H3
InChI Key:
QBNJNFYZENMFEK-UHFFFAOYSA-N
SMILES:
CCOC(=O)/C=C/C=C/CCCN=[N+]=[N-]
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.116g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.249g/mol
Monoisotopic Mass:
209.116g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
3.1
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