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397250-48-5

397250-48-5 | 9H-Carbazole-9-pentanethiol

CAS No: 397250-48-5 Catalog No: AG0037XD MDL No:

Product Description

Catalog Number:
AG0037XD
Chemical Name:
9H-Carbazole-9-pentanethiol
CAS Number:
397250-48-5
Molecular Formula:
C17H19NS
Molecular Weight:
269.4045
IUPAC Name:
5-carbazol-9-ylpentane-1-thiol
InChI:
InChI=1S/C17H19NS/c19-13-7-1-6-12-18-16-10-4-2-8-14(16)15-9-3-5-11-17(15)18/h2-5,8-11,19H,1,6-7,12-13H2
InChI Key:
MOFNTCHXCMNAHJ-UHFFFAOYSA-N
SMILES:
SCCCCCn1c2ccccc2c2c1cccc2

Properties

Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.124g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
269.406g/mol
Monoisotopic Mass:
269.124g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
5.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  

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