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1721-94-4 | 1,3-dimethylisoquinoline
CAS No: 1721-94-4 Catalog No: AG00AL0O MDL No:
Product Description
Catalog Number:
AG00AL0O
Chemical Name:
1,3-dimethylisoquinoline
CAS Number:
1721-94-4
IUPAC Name:
1,3-dimethylisoquinoline
InChI:
InChI=1S/C11H11N/c1-8-7-10-5-3-4-6-11(10)9(2)12-8/h3-7H,1-2H3
InChI Key:
SNQSGKQEGKHJCZ-UHFFFAOYSA-N
EC Number:
217-018-1
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.089g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.216g/mol
Monoisotopic Mass:
157.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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