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Home > Quinoline > 885269-27-2
885269-27-2 | 6'-Methoxy-2',3'-dihydro-1'H-spiro[cyclopropane-1,4'-isoquinoline]
CAS No: 885269-27-2 Catalog No: AG00IF4R MDL No:MFCD08234534
Product Description
Catalog Number:
AG00IF4R
Chemical Name:
6'-Methoxy-2',3'-dihydro-1'H-spiro[cyclopropane-1,4'-isoquinoline]
CAS Number:
885269-27-2
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD08234534
IUPAC Name:
6-methoxyspiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane]
InChI:
InChI=1S/C12H15NO/c1-14-10-3-2-9-7-13-8-12(4-5-12)11(9)6-10/h2-3,6,13H,4-5,7-8H2,1H3
InChI Key:
YZRYNJIQEPUEAY-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)C1(CNC2)CC1
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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