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84604-93-3 | 1,3,5-Triazine,1,3,5-triheptylhexahydro-
CAS No: 84604-93-3 Catalog No: AG004TRW MDL No:
Product Description
Catalog Number:
AG004TRW
Chemical Name:
1,3,5-Triazine,1,3,5-triheptylhexahydro-
CAS Number:
84604-93-3
Molecular Formula:
C24H51N3
Molecular Weight:
381.6818
IUPAC Name:
1,3,5-triheptyl-1,3,5-triazinane
InChI:
InChI=1S/C24H51N3/c1-4-7-10-13-16-19-25-22-26(20-17-14-11-8-5-2)24-27(23-25)21-18-15-12-9-6-3/h4-24H2,1-3H3
InChI Key:
MRRLWMPJSDXXFC-UHFFFAOYSA-N
SMILES:
CCCCCCCN1CN(CCCCCCC)CN(C1)CCCCCCC
EC Number:
283-378-1
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.408g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
381.693g/mol
Monoisotopic Mass:
381.408g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
9.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9
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