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15905-30-3 | 2-Propenoic acid, 3-(phenylseleno)-, (2Z)-
CAS No: 15905-30-3 Catalog No: AG001QG3 MDL No:
Product Description
Catalog Number:
AG001QG3
Chemical Name:
2-Propenoic acid, 3-(phenylseleno)-, (2Z)-
CAS Number:
15905-30-3
Molecular Formula:
C9H8O2Se
Molecular Weight:
227.1186
IUPAC Name:
3-phenylselanylprop-2-enoic acid
InChI:
InChI=1S/C9H8O2Se/c10-9(11)6-7-12-8-4-2-1-3-5-8/h1-7H,(H,10,11)
InChI Key:
NSIXWDHGRWRYKE-UHFFFAOYSA-N
SMILES:
OC(=O)/C=C\[Se]c1ccccc1
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.969g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.132g/mol
Monoisotopic Mass:
227.969g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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