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71611-83-1 | Isoquinoline, 3,4-dihydro-1-(1-methylethyl)- (9CI)
CAS No: 71611-83-1 Catalog No: AG00FTDL MDL No:
Product Description
Catalog Number:
AG00FTDL
Chemical Name:
Isoquinoline, 3,4-dihydro-1-(1-methylethyl)- (9CI)
CAS Number:
71611-83-1
IUPAC Name:
1-propan-2-yl-3,4-dihydroisoquinoline
InChI:
InChI=1S/C12H15N/c1-9(2)12-11-6-4-3-5-10(11)7-8-13-12/h3-6,9H,7-8H2,1-2H3
InChI Key:
UUJZSFDTGQRZDH-UHFFFAOYSA-N
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.12g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.259g/mol
Monoisotopic Mass:
173.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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