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2785-88-8 | Phenol, 5-ethyl-2-methoxy-
CAS No: 2785-88-8 Catalog No: AG002UXK MDL No:
Product Description
Catalog Number:
AG002UXK
Chemical Name:
Phenol, 5-ethyl-2-methoxy-
CAS Number:
2785-88-8
Molecular Formula:
C9H12O2
Molecular Weight:
152.1904
IUPAC Name:
5-ethyl-2-methoxyphenol
InChI:
InChI=1S/C9H12O2/c1-3-7-4-5-9(11-2)8(10)6-7/h4-6,10H,3H2,1-2H3
InChI Key:
CAWZFQGJUGEKFU-UHFFFAOYSA-N
SMILES:
CCc1ccc(c(c1)O)OC
UNII:
G8V5WHB17K
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.193g/mol
Monoisotopic Mass:
152.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Iridoid and aromatic glycosides from Scrophularia ningpoensis Hemsl. and their inhibition of [Ca2+](i) increase induced by KCl. | Chemistry & biodiversity 20080901 |
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