ChemicalBook--->CAS DataBase List--->91634-12-7

91634-12-7

91634-12-7 Structure

91634-12-7 Structure
IdentificationBack Directory
[Name]

2-VINYL-4-QUINAZOLINOL
[CAS]

91634-12-7
[Synonyms]

STIMA 1
2-VINYL-4-QUINAZOLINOL
2-Vinylquinazolin-4(3H)-one
2-vinylquinazolin-4(1H)-one
2-VINYL-3H-QUINAZOLIN-4-ONE
2-ethenyl-1H-quinazolin-4-one
4(3H)-Quinazolinone, 2-ethenyl-
2-Ethenyl-3,4-dihydroquinazolin-4-one
[Molecular Formula]

C10H8N2O
[MDL Number]

MFCD04037877
[MOL File]

91634-12-7.mol
[Molecular Weight]

172.18
Chemical PropertiesBack Directory
[Melting point ]

>200°C (dec.)
[Boiling point ]

315.4±25.0 °C(Predicted)
[density ]

1.20±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

1.91±0.20(Predicted)
[color ]

White to Off-White
[Stability:]

Light Sensitive
[InChI]

1S/C10H8N2O/c1-2-9-11-8-6-4-3-5-7(8)10(13)12-9/h2-6H,1H2,(H,11,12,13)
[InChIKey]

VCHFWHQHIKFOIC-UHFFFAOYSA-N
[SMILES]

n1c2c(c(nc1C=C)O)cccc2
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H335-H302-H319
[Precautionary statements ]

P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
[Hazard Codes ]

Xi
[WGK Germany ]

WGK 2
[HazardClass ]

IRRITANT
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

STIMA-1 can stimulate mutant p53 DNA binding in vitro and induce expression of p53 target proteins and trigger apoptosis in mutant p53-expressing human tumor cells[1].
[References]

[1] Nicole Zache, et al. Mutant p53 targeting by the low molecular weight compound STIMA-1. Mol Oncol. 2017 May;11(5):595. DOI:10.1002/1878-0261.12065
Spectrum DetailBack Directory
[Spectrum Detail]

2-VINYL-4-QUINAZOLINOL(91634-12-7)1HNMR
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