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25173-37-9 | Propanoic acid, 3-(4-methylphenoxy)-
CAS No: 25173-37-9 Catalog No: AG002QQT MDL No:MFCD00220218
Product Description
Catalog Number:
AG002QQT
Chemical Name:
Propanoic acid, 3-(4-methylphenoxy)-
CAS Number:
25173-37-9
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
MDL Number:
MFCD00220218
IUPAC Name:
3-(4-methylphenoxy)propanoic acid
InChI:
InChI=1S/C10H12O3/c1-8-2-4-9(5-3-8)13-7-6-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)
InChI Key:
GNPISAHACGIXLZ-UHFFFAOYSA-N
SMILES:
OC(=O)CCOc1ccc(cc1)C
NSC Number:
134095
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.203g/mol
Monoisotopic Mass:
180.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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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