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N-(4-bromophenyl)-4,6-bis(trichloromethyl)-1,3,5-triazin-2-amine

HCID 34965
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Basic information

CAS
30356-59-3
Standard SMILES
ClC(Cl)(Cl)c1nc(Nc2ccc(Br)cc2)nc(C(Cl)(Cl)Cl)n1
InChIKey
TYDANBVQUSWMGT-UHFFFAOYSA-N
Molecular formula
C11H5BrCl6N4
Average molar mass
485.8 g/mol
Monoisotopic mass
481.78287

Names & identifiers

Preferred name
N-(4-bromophenyl)-4,6-bis(trichloromethyl)-1,3,5-triazin-2-amine
IUPAC
N-(4-bromophenyl)-4,6-bis(trichloromethyl)-1,3,5-triazin-2-amine

Names & synonyms

N-(4-bromophenyl)-4,6-bis(trichloromethyl)-1,3,5-triazin-2-amine30356-59-3DTXSID80275138

Database identifiers

CAS
30356-59-3
PubChem CID
34965
DTXSID
DTXSID80275138
Nikkaji
J1.612.732I

Properties

Computed structural properties

XLogP
5.9
Topological polar surface area
50.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Formal charge
0
Complexity
347

Related reactions

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Compound notes

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