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1159010-39-5 | Spiro[cyclopropane-1,4'(1'H)-isoquinoline], 2',3'-dihydro-
CAS No: 1159010-39-5 Catalog No: AG000H2P MDL No:
Product Description
Catalog Number:
AG000H2P
Chemical Name:
Spiro[cyclopropane-1,4'(1'H)-isoquinoline], 2',3'-dihydro-
CAS Number:
1159010-39-5
Molecular Formula:
C11H13N
Molecular Weight:
159.2276
IUPAC Name:
spiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]
InChI:
InChI=1S/C11H13N/c1-2-4-10-9(3-1)7-12-8-11(10)5-6-11/h1-4,12H,5-8H2
InChI Key:
XGVQNSPZJDXCET-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)CNCC12CC1
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.105g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.232g/mol
Monoisotopic Mass:
159.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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