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24849-48-7 | 2-Butenoic acid, 4-(4-hydroxyphenyl)-4-oxo-
CAS No: 24849-48-7 Catalog No: AG002PMO MDL No:MFCD01814636
Product Description
Catalog Number:
AG002PMO
Chemical Name:
2-Butenoic acid, 4-(4-hydroxyphenyl)-4-oxo-
CAS Number:
24849-48-7
Molecular Formula:
C10H8O4
Molecular Weight:
192.1681
MDL Number:
MFCD01814636
IUPAC Name:
(E)-4-(4-hydroxyphenyl)-4-oxobut-2-enoic acid
InChI:
InChI=1S/C10H8O4/c11-8-3-1-7(2-4-8)9(12)5-6-10(13)14/h1-6,11H,(H,13,14)/b6-5+
InChI Key:
LQCBGQDCRBYBMK-AATRIKPKSA-N
SMILES:
OC(=O)C=CC(=O)c1ccc(cc1)O
NSC Number:
400878
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
192.042g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.17g/mol
Monoisotopic Mass:
192.042g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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