Home Other Building Blocks rac 4-Hydroxydebrisoquine Hemisulfate

rac 4-Hydroxydebrisoquine Hemisulfate

CAS No.:
62580-84-1
Catalog Number:
AG00EFDU
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00EFDU
Chemical Name:
rac 4-Hydroxydebrisoquine Hemisulfate
CAS Number:
62580-84-1
MDL Number:
MFCD09840718
IUPAC Name:
4-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboximidamide;sulfuric acid
InChI:
InChI=1S/2C10H13N3O.H2O4S/c2*11-10(12)13-5-7-3-1-2-4-8(7)9(14)6-13;1-5(2,3)4/h2*1-4,9,14H,5-6H2,(H3,11,12);(H2,1,2,3,4)
InChI Key:
AETJLQVZNVTWPH-UHFFFAOYSA-N
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
480.179g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
8  
Isotope Atom Count:
0
Molecular Weight:
480.54g/mol
Monoisotopic Mass:
480.179g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
230A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties