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74477-04-6 | Isoquinoline, 1,2-dihydro-1-methylene-
CAS No: 74477-04-6 Catalog No: AG005BDH MDL No:MFCD28678408
Product Description
Catalog Number:
AG005BDH
Chemical Name:
Isoquinoline, 1,2-dihydro-1-methylene-
CAS Number:
74477-04-6
Molecular Formula:
C10H9N
Molecular Weight:
143.1852
MDL Number:
MFCD28678408
IUPAC Name:
1-methylidene-2H-isoquinoline
InChI:
InChI=1S/C10H9N/c1-8-10-5-3-2-4-9(10)6-7-11-8/h2-7,11H,1H2
InChI Key:
QZYFALWAANHYAZ-UHFFFAOYSA-N
SMILES:
C=c1[nH]ccc2c1cccc2
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.073g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
143.189g/mol
Monoisotopic Mass:
143.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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