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1691058-33-9,MFCD30311029
Catalog No.:AA01BRJQ
1691058-33-9 | 4-(chloromethyl)-1-methoxyisoquinoline
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Technical Information
Catalog Number:
AA01BRJQ
Chemical Name:
4-(chloromethyl)-1-methoxyisoquinoline
CAS Number:
1691058-33-9
MDL Number:
MFCD30311029
IUPAC Name:
4-(chloromethyl)-1-methoxyisoquinoline
InChI:
InChI=1S/C11H10ClNO/c1-14-11-10-5-3-2-4-9(10)8(6-12)7-13-11/h2-5,7H,6H2,1H3
InChI Key:
HMLOWMRLVRAOAY-UHFFFAOYSA-N
Properties
Computed Properties
 
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.045g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.657g/mol
Monoisotopic Mass:
207.045g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

Synonyms
 
4-(chloromethyl)-1-methoxyisoquinoline 
1691058-33-9 
SCHEMBL20669649 
ZINC234938087 
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