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93627-52-2 | Isoquinoline, 1,2,3,4-tetrahydro-2-(1-methylethyl)- (9CI)
CAS No: 93627-52-2 Catalog No: AG00H0OZ MDL No:
Product Description
Catalog Number:
AG00H0OZ
Chemical Name:
Isoquinoline, 1,2,3,4-tetrahydro-2-(1-methylethyl)- (9CI)
CAS Number:
93627-52-2
IUPAC Name:
2-propan-2-yl-3,4-dihydro-1H-isoquinoline
InChI:
InChI=1S/C12H17N/c1-10(2)13-8-7-11-5-3-4-6-12(11)9-13/h3-6,10H,7-9H2,1-2H3
InChI Key:
UKXXZHBWKKSUGE-UHFFFAOYSA-N
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.136g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.275g/mol
Monoisotopic Mass:
175.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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