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2,2'-(1,4-Phenylene)bis(4,5-dihydro-1H-imidazole)

HCID 414907
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3617-11-6
Standard SMILES
c1cc(C2=NCCN2)ccc1C1=NCCN1
InChIKey
VTSKAODQSCDUDE-UHFFFAOYSA-N
Molecular formula
C12H14N4
Average molar mass
214.27 g/mol
Monoisotopic mass
214.12184646

Names & identifiers

Preferred name
2,2'-(1,4-Phenylene)bis(4,5-dihydro-1H-imidazole)
IUPAC
2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4,5-dihydro-1H-imidazole
English name
2,2'-(1,4-Phenylene)bis(4,5-dihydro-1H-iMidazole)
Molecular formula
C12H14N4
Molecular weight
214.27

Names & synonyms

3617-11-62,2'-(1,4-Phenylene)bis(4,5-dihydro-1H-imidazole)2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-4,5-dihydro-1H-imidazole1,4-bis(4,5-dihydro-1h-imidazol-2-yl)benzeneMFCD20260123STK3678891H-Imidazole, 2,2'-(1,4-phenylene)bis[4,5-dihydro-2,2'-(1,4-Phenylene)di(4,5-dihydro-1H-imidazole)SCHEMBL5476725DTXSID50328887VTSKAODQSCDUDE-UHFFFAOYSA-NAKOS005445119
Show more names
AB92617F789152,2'-benzene-1,4-diylbis(4,5-dihydro-1H-imidazole)2-[4-(4,5-Dihydro-1H-pyrrol-2-yl)-phenyl]-4,5-dihydro-1H-imidazole

Database identifiers

CAS
3617-11-6
PubChem CID
414907
DTXSID
DTXSID50328887
Nikkaji
J711.842B

Properties

Computed structural properties

XLogP
-0.2
Topological polar surface area
48.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
281

Physicochemical properties

Melting point
296 · 296-297 °C
Boiling point
366.6 · 366.6±52.0 °C(Predicted)
Density
1.34 · 1.34±0.1 g/cm3(Predicted)
storage temp.
Store at Room Tem.
pka
10.06 · 10.06±0.40(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501

Safety & regulation

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

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319-H335
Precautionary statements
P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501

Chemistry & industry

Suppliers2 total

苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]

Related reactions

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Compound notes

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