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114567-94-1 | 2-Propenoic acid, 3-(4-azidophenyl)-, methyl ester
CAS No: 114567-94-1 Catalog No: AG000EPW MDL No:
Product Description
Catalog Number:
AG000EPW
Chemical Name:
2-Propenoic acid, 3-(4-azidophenyl)-, methyl ester
CAS Number:
114567-94-1
Molecular Formula:
C10H9N3O2
Molecular Weight:
203.1974
IUPAC Name:
methyl 3-(4-azidophenyl)prop-2-enoate
InChI:
InChI=1S/C10H9N3O2/c1-15-10(14)7-4-8-2-5-9(6-3-8)12-13-11/h2-7H,1H3
InChI Key:
ARKZMTWAXDUTKN-UHFFFAOYSA-N
SMILES:
COC(=O)C=Cc1ccc(cc1)N=[N+]=[N-]
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.201g/mol
Monoisotopic Mass:
203.069g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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