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1211876-16-2 | 1-(1,2,3,4-Tetrahydroisoquinolin-6-yl)ethanone hydrochloride
CAS No: 1211876-16-2 Catalog No: AG0073Z3 MDL No:MFCD23135751
Product Description
Catalog Number:
AG0073Z3
Chemical Name:
1-(1,2,3,4-Tetrahydroisoquinolin-6-yl)ethanone hydrochloride
CAS Number:
1211876-16-2
Molecular Formula:
C11H14ClNO
Molecular Weight:
211.6880
MDL Number:
MFCD23135751
IUPAC Name:
1-(1,2,3,4-tetrahydroisoquinolin-6-yl)ethanone;hydrochloride
InChI:
InChI=1S/C11H13NO.ClH/c1-8(13)9-2-3-11-7-12-5-4-10(11)6-9;/h2-3,6,12H,4-5,7H2,1H3;1H
InChI Key:
TUKVVUNVACVJHN-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc2c(c1)CCNC2.Cl
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.076g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
211.689g/mol
Monoisotopic Mass:
211.076g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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