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74595-94-1

74595-94-1 | Dihydro-2,4,6-tris(2-methylpropyl)-4H-1,3,5-dithiazine

CAS No: 74595-94-1 Catalog No: AG0038GB MDL No:MFCD06409998

Product Description

Catalog Number:
AG0038GB
Chemical Name:
Dihydro-2,4,6-tris(2-methylpropyl)-4H-1,3,5-dithiazine
CAS Number:
74595-94-1
Molecular Formula:
C15H31NS2
Molecular Weight:
289.5433
MDL Number:
MFCD06409998
IUPAC Name:
2,4,6-tris(2-methylpropyl)-1,3,5-dithiazinane
InChI:
InChI=1S/C15H31NS2/c1-10(2)7-13-16-14(8-11(3)4)18-15(17-13)9-12(5)6/h10-16H,7-9H2,1-6H3
InChI Key:
RQGPQWUKHADVPF-UHFFFAOYSA-N
SMILES:
CC(CC1NC(CC(C)C)SC(S1)CC(C)C)C
EC Number:
457-290-0
FEMA Number:
4017

Properties

Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.19g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
289.54g/mol
Monoisotopic Mass:
289.19g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4  

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