2,3-bis(4-hydroxyphenyl)propionitrile

Names

[ Name ]:
2,3-bis(4-hydroxyphenyl)propionitrile

[Synonym ]:
2,3-bis(4-hydroxyphenyl)propionitrile
DPN Diarylpropionitrile SC-4473
2,3-Bis(4-hydroxyphenyl)propanenitrile
Benzenepropanenitrile, 4-hydroxy-α-(4-hydroxyphenyl)-
DPN

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
449.4±35.0 °C at 760 mmHg

[ Melting Point ]:
203°C

[ Molecular Formula ]:
C₁₅H₁₃NO₂

[ Molecular Weight ]:
239.269

[ Flash Point ]:
225.6±25.9 °C

[ Exact Mass ]:
239.094635

[ PSA ]:
64.25000

[ LogP ]:
2.06

[ Vapour Pressure ]:
0.0±1.1 mmHg at 25°C

[ Index of Refraction ]:
1.640

[ Storage condition ]:
-20°C

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UG0900000

CHEMICAL NAME :: Propionitrile, 2,3-bis(p-hydroxyphenyl)

CAS REGISTRY NUMBER :: 1428-67-7

BEILSTEIN REFERENCE NO. :: 3337109

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C15-H13-N-O2

MOLECULAR WEIGHT :: 239.29

WISWESSER LINE NOTATION :: QR DYCN&1R DQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 1500 mg/kg

TOXIC EFFECTS :: Behavioral - tremor Behavioral - muscle weakness Behavioral - ataxia

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 112,176,1954

Safety Information

[ Symbol ]:

GHS07, GHS09

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H319-H400

[ Precautionary Statements ]:
P273-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ RIDADR ]:
UN 3077 9 / PGIII

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

2,3-bis(4-methoxyphenyl)propanenitrile
1-bromomethyl-4-methoxybenzene
(4-Methoxyphenyl)acetonitrile

DownStream

Articles

A precisely substituted benzopyran targets androgen refractory prostate cancer cells through selective modulation of estrogen receptors.

Toxicol. Appl. Pharmacol. 283(3) , 187-97, (2015)

Dietary consumption of phytoestrogens like genistein has been linked with lower incidence of prostate cancer. The estradiol-like benzopyran core of genistein confers estrogen receptor-β (ER-β) selecti...

Classical and membrane-initiated estrogen signaling in an in vitro model of anterior hypothalamic kisspeptin neurons.

Endocrinology 156 , 2162-73, (2015)

The neuropeptide kisspeptin is essential for sexual maturation and reproductive function. In particular, kisspeptin-expressing neurons in the anterior rostral periventricular area of the third ventric...

Methyltransferase-like 17 physically and functionally interacts with estrogen receptors.

IUBMB Life 67 , 861-8, (2016)

Estrogen exerts its physiological and pathological functions through two estrogen receptors (ERs), ERα and ERβ, which act as transcription factors. Coregulators, including coactivators and corepressor...

2,3-bis(4-hydroxyphenyl)but-2-enedinitrile
2,3-bis(4-hydroxyphenyl)cyclopent-2-en-1-one
2,3-bis(4-hydroxyphenyl)propane-1,2-diol
2,3-bis(4-hydroxyphenyl)pentanenitrile
2,3-bis(4-hydroxyphenyl)-1,3a-dihydropyrazolo[1,5-a]pyrimidin-6-ol
2,3-bis(4-hydroxyphenyl)prop-2-enenitrile
9-(4-ethoxyphenyl)-1,7-dimethyl-3-(3-phenylpropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(4-bromophenyl)-1,7-dimethyl-3-[(3-methylphenyl)methyl]-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
1,3,7-trimethyl-9-(4-phenoxyphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(3-chlorophenyl)-1-methyl-3-(2-methylbenzyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(3-chlorophenyl)-3-isopentyl-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
8-(3-chloro-4-methylphenyl)-1,7-dimethyl-3-phenethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
8-(2-(benzyl(methyl)amino)ethyl)-1,7-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
8-(2-chloroethyl)-1,7-dimethyl-3-(3-methylbenzyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
4,7,8-Trimethyl-2-(2-methylprop-2-enyl)-6-(1-phenylethyl)purino[7,8-a]imidazole-1,3-dione
7-(4-chlorophenyl)-1-methyl-3-(4-methylbenzyl)oxazolo[2,3-f]purine-2,4(1H,3H)-dione

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