Home Halogens 5-bromo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrochloride

5-bromo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrochloride

CAS No.:
178205-85-1
Catalog Number:
AG01ELIG
Molecular Formula:
C10H11BrClNO2
Molecular Weight:
292.5568
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Product Description
Catalog Number:
AG01ELIG
Chemical Name:
5-bromo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrochloride
CAS Number:
178205-85-1
Molecular Formula:
C10H11BrClNO2
Molecular Weight:
292.5568
MDL Number:
MFCD31457043
IUPAC Name:
5-bromo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C10H10BrNO2.ClH/c11-8-3-1-2-6-5-12-9(10(13)14)4-7(6)8;/h1-3,9,12H,4-5H2,(H,13,14);1H
InChI Key:
QNSTWZBFWXFFJP-UHFFFAOYSA-N
SMILES:
OC(=O)C1NCc2c(C1)c(Br)ccc2.Cl
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.966g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
292.557g/mol
Monoisotopic Mass:
290.966g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties