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Home > Imidazoles > 204783-09-5
204783-09-5 | 2-Propenoic acid, 3-(1H-imidazol-5-yl)-, 2-propen-1-yl ester
CAS No: 204783-09-5 Catalog No: AG0029P6 MDL No:
Product Description
Catalog Number:
AG0029P6
Chemical Name:
2-Propenoic acid, 3-(1H-imidazol-5-yl)-, 2-propen-1-yl ester
CAS Number:
204783-09-5
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
IUPAC Name:
prop-2-enyl 3-(1H-imidazol-5-yl)prop-2-enoate
InChI:
InChI=1S/C9H10N2O2/c1-2-5-13-9(12)4-3-8-6-10-7-11-8/h2-4,6-7H,1,5H2,(H,10,11)
InChI Key:
VAMVZIQVCJRUTG-UHFFFAOYSA-N
SMILES:
C=CCOC(=O)C=Cc1cnc[nH]1
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.191g/mol
Monoisotopic Mass:
178.074g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1
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