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24693-40-1 | Isoquinoline, 1,2,3,4-tetrahydro-8-methoxy-, hydrochloride (1:1)
CAS No: 24693-40-1 Catalog No: AG002P1X MDL No:MFCD05861545
Product Description
Catalog Number:
AG002P1X
Chemical Name:
Isoquinoline, 1,2,3,4-tetrahydro-8-methoxy-, hydrochloride (1:1)
CAS Number:
24693-40-1
Molecular Formula:
C10H14ClNO
Molecular Weight:
199.6773
MDL Number:
MFCD05861545
IUPAC Name:
8-methoxy-1,2,3,4-tetrahydroisoquinoline;hydrochloride
InChI:
InChI=1S/C10H13NO.ClH/c1-12-10-4-2-3-8-5-6-11-7-9(8)10;/h2-4,11H,5-7H2,1H3;1H
InChI Key:
RRDQVRPDJGDAJS-UHFFFAOYSA-N
SMILES:
COc1cccc2c1CNCC2.Cl
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.076g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.678g/mol
Monoisotopic Mass:
199.076g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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