9-(Bromomethyl)anthracene - CAS 2417-77-8

Catalog:	BB018356
Product Name:	9-(Bromomethyl)anthracene
CAS:	2417-77-8
Synonyms:	9-(bromomethyl)anthracene; 9-(bromomethyl)anthracene

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Computed Properties

IUPAC Name:	9-(bromomethyl)anthracene
Description:	9-(Bromomethyl)anthracene (CAS# 2417-77-8) is a useful research chemical.
Molecular Weight:	271.15
Molecular Formula:	C15H11Br
Canonical SMILES:	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2CBr
InChI:	InChI=1S/C15H11Br/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-9H,10H2
InChI Key:	KOWKPLCVFRHICH-UHFFFAOYSA-N
Boiling Point:	411.7 °C / 760 mmHg
Density:	1.448 g/cm³
Storage:	Inert atmosphere. Keep cold.
MDL:	MFCD00096212
LogP:	4.88790

Publication Number	Title	Priority Date
WO-2021187056-A1	Method for producing plate denture, curable stereolithographic composition, and plate denture production kit	20200317
KR-20210101082-A	(arylmethyl)arenes and a production process thereof	20200207
US-2021188739-A1	Method for producing arene compounds and arene compounds produced by the same	20191220
CN-110092720-A	A kind of bisphenol hydroxy monomer containing anthracyl radical and its synthetic method and application	20190429
EP-3808750-A1	Triazolinedione adduct, method for producing triazolinedione adduct, method for producing ene compound, and method for analyzing ene compound	20180612

PMID	Publication Date	Title	Journal
16292799	20051125	Bicyclo[2.2.2]octene-based 'crab-like' molecules: synthesis, complexation, luminescence properties, and solid-state structures	The Journal of organic chemistry

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GHS Hazard Statement:	H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P273, P301+P312, P330, P391, and P501
Signal Word:	Warning

Complexity:	216
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	270.00441
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	270.00441
Rotatable Bond Count:	1
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	5.3