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1,3,5-Triazine-2,4-diamine, 6-chloro-N2,N4-diphenyl-

HCID 16088
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Basic information

CAS
1973-09-7
Standard SMILES
Clc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1
InChIKey
AHBSUJXKRKWNBN-UHFFFAOYSA-N
Molecular formula
C15H12ClN5
Average molar mass
297.74 g/mol
Monoisotopic mass
297.07812306

Names & identifiers

Preferred name
1,3,5-Triazine-2,4-diamine, 6-chloro-N2,N4-diphenyl-
IUPAC
6-chloro-2-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine
English name
AKOS BBS-00005387
Molecular formula
C15H12ClN5
Molecular weight
297.74

Names & synonyms

2,4-Bis(phenylamino)-6-chloro-1,3,5-triazineNSC 764821,3,5-Triazine-2,4-diamine, 6-chloro-N2,N4-diphenyl-RefChem:4126131973-09-76-chloro-N2,N4-diphenyl-1,3,5-triazine-2,4-diamine1,3,5-Triazine-2,4-diamine, 6-chloro-N,N'-diphenyl-6-chloro-N,N'-diphenyl-1,3,5-triazine-2,4-diamineAKOS BBS-00005387MFCD004122946-chloro-2-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine[4-chloro-6-(phenylamino)(1,3,5-triazin-2-yl)]phenylamine
Show more names
ASISCHEM U52582CHEMBRDG-BB 5101452[4-(anilino)-6-chloro-s-triazin-2-yl]-phenyl-amine6-chloro-N2,N4-di(phenyl)-1,3,5-triazine-2,4-diamine6-chloro-2-N,4-N-di(phenyl)-1,3,5-triazine-2,4-diamine6-chloro-N,N'-diphenyl-1,3,5-triazine-2,4-diamine(SALTDATA: FREE)
NSC764822,4-Dianilino-6-chloro-1,3,5-triazineNCIOpen2_004033CBDivE_013039MLS000566591SCHEMBL19238836-Chloro-N,N'-diphenyl-[1,3,5]triazine-2,4-diamineCHEMBL1523961

Database identifiers

CAS
1973-09-7
PubChem CID
16088
DTXSID
DTXSID1062091
ChEMBL
CHEMBL1523961
Nikkaji
J846.021C

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
62.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
Formal charge
0
Complexity
276

Experimental & physicochemical properties

SpringerMaterials PropertiesDiamagnetic susceptibility

Physicochemical properties

storage temp.
2 · 2-8°C, protect from light
Appearance
White to off-white Solid
EPA Substance Registry System
1 · 1,3,5-Triazine-2,4-diamine, 6-chloro-N,N'-diphenyl- (1973-09-7)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Safety data

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1,3,5-Triazine-2,4-diamine, 6-chloro-N2,N4-diphenyl-: INACTIVE

Related reactions

4 records
New reaction record
HRID 97085 reaction equation
HRID 97085As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 818673 reaction equation
HRID 818673As reactantTest data from https://doi.org/10.1039/C8SC04228D
HRID 2223824 reaction equation
HRID 2223824As reactantuspto-grants-2008_05
HRID 2223826 reaction equation
HRID 2223826As reactantuspto-grants-2008_05

Compound notes

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