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33351-43-8 | 1-Butyl-3,4-dihydroisoquinoline
CAS No: 33351-43-8 Catalog No: AG00CSTN MDL No:
Product Description
Catalog Number:
AG00CSTN
Chemical Name:
1-Butyl-3,4-dihydroisoquinoline
CAS Number:
33351-43-8
IUPAC Name:
1-butyl-3,4-dihydroisoquinoline
InChI:
InChI=1S/C13H17N/c1-2-3-8-13-12-7-5-4-6-11(12)9-10-14-13/h4-7H,2-3,8-10H2,1H3
InChI Key:
UASPWZSDZPTJHQ-UHFFFAOYSA-N
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.286g/mol
Monoisotopic Mass:
187.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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