Chlorotrianisene

HCID 11289CAS 569-57-3

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Basic information

Standard SMILES
COc1ccc(C(Cl)=C(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1
InChIKey
BFPSDSIWYFKGBC-UHFFFAOYSA-N
Molecular formula
C23H21ClO3
Average molar mass
380.871 g/mol
Monoisotopic mass
380.11792221

Names & identifiers

Preferred name
Chlorotrianisene
IUPAC
1,1',1''-(2-Chloroethene-1,1,2-triyl)tris(4-methoxybenzene)
English name
Chlorotrianisene
Molecular formula
C23H21ClO3
Molecular weight
380.86

Names & synonyms

Chlorotrianisene (1 g)CSVPTaceADA17NISBDMetaceRianilCD156bNISBD1ADAM 17

Database identifiers

CAS
569-57-3
PubChem CID
11289
DTXSID
DTXSID1021299
ChEMBL
CHEMBL1200761
ChEBI
CHEBI:3641
UNII
6V5034L121
EC Number
209-318-6
Nikkaji
J6.531E

Properties

Physicochemical properties

Melting point
114 · 114-116°
Boiling point
496.07 °C · 496.07°C (rough estimate)
Density
1.101 · 1.1010 (rough estimate)
refractive index
1.4585 · 1.4585 (estimate)
storage temp.
-20 °C · Inert atmosphere,Store in freezer, under -20°C
solubility
2 O; · insoluble in H2O; insoluble in EtOH; ≥16.1 mg/mL in DMSO

Safety & regulation

Safety data

wgk
3
rtecs
KV0600000
Signal word
Danger
Symbol(GHS)
GHS07,GHS08
Storage Class
10 - Combustible liquids
Hazardous Substances Data
569-57-3(Hazardous Substances Data)

Chemistry & industry

Applications · 3 items

UsesEstrogen.

UsesChlorotrianisene USP (TACE) is used to treat Androgen dependent carcinoma of the prostate.

General DescriptionSmall white crystals or white powder. Softens at 226°F. Odorless.

Upstream & downstream products

Suppliers50 total

北京华美互利生物化工010-56205725 · [email protected]
南通飞宇生物科技有限公司0513-68819626 15152877458 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
盐城通铭生物科技有限公司15195160625 · [email protected]
上海钰博生物科技有限公司021-60514606 18321282235 · [email protected]

Additional notes

DefinitionChEBI: Chlorotrianisene is a chloroalkene. It has a role as an estrogen receptor modulator, an antineoplastic agent and a xenoestrogen. It derives from a hydride of a stilbene.

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