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937602-48-7 | 2-(4-heptylphenyl)-1,3-thiazolidine
CAS No: 937602-48-7 Catalog No: AG00IHTE MDL No:MFCD09027145
Product Description
Catalog Number:
AG00IHTE
Chemical Name:
2-(4-heptylphenyl)-1,3-thiazolidine
CAS Number:
937602-48-7
Molecular Formula:
C16H25NS
Molecular Weight:
263.4414
MDL Number:
MFCD09027145
IUPAC Name:
2-(4-heptylphenyl)-1,3-thiazolidine
InChI:
InChI=1S/C16H25NS/c1-2-3-4-5-6-7-14-8-10-15(11-9-14)16-17-12-13-18-16/h8-11,16-17H,2-7,12-13H2,1H3
InChI Key:
YATIBVVJYZDFRO-UHFFFAOYSA-N
SMILES:
CCCCCCCc1ccc(cc1)C1NCCS1
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.171g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.443g/mol
Monoisotopic Mass:
263.171g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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