ChemicalBook--->CAS DataBase List--->20934-81-0

20934-81-0

20934-81-0 Structure

20934-81-0 Structure
IdentificationBack Directory
[Name]

4-BENZOOXAZOL-2-YL-PHENYLAMINE
[CAS]

20934-81-0
[Synonyms]

AKOS BB-8497
ASISCHEM T30955
CHEMBRDG-BB 4101678
TIMTEC-BB SBB000494
OTAVA-BB BB7216513381
LABOTEST-BB LT00133884
2-[4-Aminophenyl]benzoxazole
4-(2-Benzoxazolyl)benzenamine
4-BENZOOXAZOL-2-YL-PHENYLAMIN
4-(1,3-BENZOXAZOL-2-YL)ANILINE
4-(BENZO[D]OXAZOL-2-YL)ANILINE
4-BENZOOXAZOL-2-YL-PHENYLAMINE
Benzenamine, 4-(2-benzoxazolyl)-
4-(1,3-BENZOXAZOL-2-YL)PHENYLAMINE
4-(1,3-benzoxazol-2-yl)aniline(SALTDATA: FREE)
[EINECS(EC#)]

200-258-5
[Molecular Formula]

C13H10N2O
[MDL Number]

MFCD00453046
[MOL File]

20934-81-0.mol
[Molecular Weight]

210.23
Chemical PropertiesBack Directory
[Melting point ]

169-170 °C
[Boiling point ]

361.4±25.0 °C(Predicted)
[density ]

1.257±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[solubility ]

DMSO : ≥ 100 mg/mL (475.67 mM)
[form ]

Solid
[pka]

3.29±0.10(Predicted)
[color ]

Light brown to brown
[InChI]

InChI=1S/C13H10N2O/c14-10-7-5-9(6-8-10)13-15-11-3-1-2-4-12(11)16-13/h1-8H,14H2
[InChIKey]

XZYQBYQGHHGXBC-UHFFFAOYSA-N
[SMILES]

C1(N)=CC=C(C2=NC3=CC=CC=C3O2)C=C1
[EPA Substance Registry System]

Benzenamine, 4-(2-benzoxazolyl)- (20934-81-0)
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H301
[Precautionary statements ]

P501-P270-P264-P301+P310+P330-P405
[Hazard Codes ]

Xi
[TSCA ]

TSCA listed
[HazardClass ]

IRRITANT
[HS Code ]

2934999090
Hazard InformationBack Directory
[Uses]

4-(Benzo[d]oxazol-2-yl)aniline is a potent antitumor agent. 4-(Benzo[d]oxazol-2-yl)aniline has inhibitory activity against mammary carcinoma cell lines[1].
[Synthesis Reference(s)]

Journal of Medicinal Chemistry, 39, p. 3375, 1996 DOI: 10.1021/jm9600959
[References]

[1] Shi DF, et al. Antitumor benzothiazoles. 3. Synthesis of 2-(4-aminophenyl)benzothiazoles and evaluation of their activities against breast cancer cell lines in vitro and in vivo. J Med Chem. 1996 Aug 16;39(17):3375-84. DOI:10.1021/jm9600959
Spectrum DetailBack Directory
[Spectrum Detail]

4-BENZOOXAZOL-2-YL-PHENYLAMINE(20934-81-0)1HNMR
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