Home Carboxys 7-fluoro-1,2,3,4-tetrahydroisoquinoline-8-carboxylic acid hydrochloride

7-fluoro-1,2,3,4-tetrahydroisoquinoline-8-carboxylic acid hydrochloride

CAS No.:
1989671-78-4
Catalog Number:
AG01B6O8
Molecular Formula:
C10H11ClFNO2
Molecular Weight:
231.6512
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Product Description
Catalog Number:
AG01B6O8
Chemical Name:
7-fluoro-1,2,3,4-tetrahydroisoquinoline-8-carboxylic acid hydrochloride
CAS Number:
1989671-78-4
Molecular Formula:
C10H11ClFNO2
Molecular Weight:
231.6512
MDL Number:
MFCD30342891
IUPAC Name:
7-fluoro-1,2,3,4-tetrahydroisoquinoline-8-carboxylic acid;hydrochloride
InChI:
InChI=1S/C10H10FNO2.ClH/c11-8-2-1-6-3-4-12-5-7(6)9(8)10(13)14;/h1-2,12H,3-5H2,(H,13,14);1H
InChI Key:
XUSBHVZFHHEMBD-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(F)ccc2c1CNCC2.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:
231.046g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
231.651g/mol
Monoisotopic Mass:
231.046g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties