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184880-25-9 | Isoquinoline, 1,2,3,4-tetrahydro-1-(methoxymethyl)-
CAS No: 184880-25-9 Catalog No: AG0074SJ MDL No:
Product Description
Catalog Number:
AG0074SJ
Chemical Name:
Isoquinoline, 1,2,3,4-tetrahydro-1-(methoxymethyl)-
CAS Number:
184880-25-9
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
IUPAC Name:
1-(methoxymethyl)-1,2,3,4-tetrahydroisoquinoline
InChI:
InChI=1S/C11H15NO/c1-13-8-11-10-5-3-2-4-9(10)6-7-12-11/h2-5,11-12H,6-8H2,1H3
InChI Key:
CVQNVDFNUAHUOO-UHFFFAOYSA-N
SMILES:
COCC1NCCc2c1cccc2
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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