Home Halogens 2-tert-butyl-4-chloro-1,3,5-triazine

2-tert-butyl-4-chloro-1,3,5-triazine

CAS No.:
1417517-78-2
Catalog Number:
AG01DQS4
Molecular Formula:
C7H10ClN3
Molecular Weight:
171.6274
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Product Description
Catalog Number:
AG01DQS4
Chemical Name:
2-tert-butyl-4-chloro-1,3,5-triazine
CAS Number:
1417517-78-2
Molecular Formula:
C7H10ClN3
Molecular Weight:
171.6274
MDL Number:
MFCD23143823
IUPAC Name:
2-tert-butyl-4-chloro-1,3,5-triazine
InChI:
InChI=1S/C7H10ClN3/c1-7(2,3)5-9-4-10-6(8)11-5/h4H,1-3H3
InChI Key:
IORDUCIBYMFXQP-UHFFFAOYSA-N
SMILES:
CC(c1ncnc(n1)Cl)(C)C
Properties
Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.056g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.628g/mol
Monoisotopic Mass:
171.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties