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1008-19-1 | Naphthalene, 1,2,3,4-tetrahydro-5-methoxy-
CAS No: 1008-19-1 Catalog No: AG0002WN MDL No:MFCD22536129
Product Description
Catalog Number:
AG0002WN
Chemical Name:
Naphthalene, 1,2,3,4-tetrahydro-5-methoxy-
CAS Number:
1008-19-1
Molecular Formula:
C11H14O
Molecular Weight:
162.2283
MDL Number:
MFCD22536129
IUPAC Name:
5-methoxy-1,2,3,4-tetrahydronaphthalene
InChI:
InChI=1S/C11H14O/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h4,6,8H,2-3,5,7H2,1H3
InChI Key:
OXXFHUMKHSSUNG-UHFFFAOYSA-N
SMILES:
COc1cccc2c1CCCC2
NSC Number:
5242
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.104g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.232g/mol
Monoisotopic Mass:
162.104g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Literature
| Title | Journal |
|---|---|
| F281, synthetic agonist of the sigma-2 receptor, induces Ca2+ efflux from the endoplasmic reticulum and mitochondria in SK-N-SH cells. | Cell calcium 20090401 |
| Transition-state effects in acid-catalyzed aryl epoxide hydrolyses. | The Journal of organic chemistry 20040806 |
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