Home Other Building Blocks 1,2,3,4,5,6-hexahydro-1-benzazocine hydrochloride

1,2,3,4,5,6-hexahydro-1-benzazocine hydrochloride

CAS No.:
1354951-27-1
Catalog Number:
AG019S51
Molecular Formula:
C11H16ClN
Molecular Weight:
197.7044
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Product Description
Catalog Number:
AG019S51
Chemical Name:
1,2,3,4,5,6-hexahydro-1-benzazocine hydrochloride
CAS Number:
1354951-27-1
Molecular Formula:
C11H16ClN
Molecular Weight:
197.7044
MDL Number:
MFCD20441773
IUPAC Name:
1,2,3,4,5,6-hexahydro-1-benzazocine;hydrochloride
InChI:
InChI=1S/C11H15N.ClH/c1-2-6-10-7-3-4-8-11(10)12-9-5-1;/h3-4,7-8,12H,1-2,5-6,9H2;1H
InChI Key:
YRPMNVSJYGEGTP-UHFFFAOYSA-N
SMILES:
C1CCNc2c(CC1)cccc2.Cl
Properties
Complexity:
133  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.097g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
197.706g/mol
Monoisotopic Mass:
197.097g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties