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208-75-3

208-75-3 | 1,4-Methano-9H-carbazole

CAS No: 208-75-3 Catalog No: AG002JFU MDL No:

Product Description

Catalog Number:
AG002JFU
Chemical Name:
1,4-Methano-9H-carbazole
CAS Number:
208-75-3
Molecular Formula:
C13H9N
Molecular Weight:
179.2173
IUPAC Name:
5-methoxy-1,3-dihydrobenzimidazol-2-one
InChI:
InChI=1S/C8H8N2O2/c1-12-5-2-3-6-7(4-5)10-8(11)9-6/h2-4H,1H3,(H2,9,10,11)
InChI Key:
AUPLVAKFTYFHTA-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)[nH]c1c2c2ccc1C2

Properties

Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.059g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
164.164g/mol
Monoisotopic Mass:
164.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  

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