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Home > Other Heterocycles > 1909327-70-3
1909327-70-3 | 1-phenyl-2-azaspiro[3.4]oct-6-ene
CAS No: 1909327-70-3 Catalog No: AG01C52T MDL No:MFCD29763281
Product Description
Catalog Number:
AG01C52T
Chemical Name:
1-phenyl-2-azaspiro[3.4]oct-6-ene
CAS Number:
1909327-70-3
Molecular Formula:
C13H15N
Molecular Weight:
185.2649
MDL Number:
MFCD29763281
IUPAC Name:
3-phenyl-2-azaspiro[3.4]oct-6-ene
InChI:
InChI=1S/C13H15N/c1-2-6-11(7-3-1)12-13(10-14-12)8-4-5-9-13/h1-7,12,14H,8-10H2
InChI Key:
CJYDNQIUMXIPAV-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1NCC21CC=CC2
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.12g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.27g/mol
Monoisotopic Mass:
185.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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