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1196-87-8 | 1H-Naphth[1,2-b]azirine, 1a,2,3,7b-tetrahydro-
CAS No: 1196-87-8 Catalog No: AG000P95 MDL No:
Product Description
Catalog Number:
AG000P95
Chemical Name:
1H-Naphth[1,2-b]azirine, 1a,2,3,7b-tetrahydro-
CAS Number:
1196-87-8
Molecular Formula:
C10H11N
Molecular Weight:
145.2010
IUPAC Name:
1a,2,3,7b-tetrahydro-1H-naphtho[1,2-b]azirine
InChI:
InChI=1S/C10H11N/c1-2-4-8-7(3-1)5-6-9-10(8)11-9/h1-4,9-11H,5-6H2
InChI Key:
STIAGRVYHJJMCC-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)C1NC1CC2
NSC Number:
107260
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.089g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
145.205g/mol
Monoisotopic Mass:
145.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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