CAS 57455-06-8|3-IODOBENZYL ALCOHOL

Introduction：Basic information about CAS 57455-06-8|3-IODOBENZYL ALCOHOL, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Safety Information
5. Customs
6. Articles4
7. Synonyms

Common Name	3-IODOBENZYL ALCOHOL
CAS Number	57455-06-8	Molecular Weight	234.03400
Density	1.842 g/mL at 25 °C(lit.)	Boiling Point	252 °C711 mm Hg(lit.)
Molecular Formula	C₇H₇IO	Melting Point	/
MSDS	ChineseUSA	Flash Point	>230 °F

Names

Name	3-iodobenzyl alcohol
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.842 g/mL at 25 °C(lit.)
Boiling Point	252 °C711 mm Hg(lit.)
Molecular Formula	C₇H₇IO
Molecular Weight	234.03400
Flash Point	>230 °F
Exact Mass	233.95400
PSA	20.23000
LogP	1.78350
Index of Refraction	n20/D 1.636(lit.)
InChIKey	QGCCNWSXJHGUNL-UHFFFAOYSA-N
SMILES	OCc1cccc(I)c1

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DO8318000

CHEMICAL NAME :: Benzyl alcohol, m-iodo-

CAS REGISTRY NUMBER :: 57455-06-8

BEILSTEIN REFERENCE NO. :: 3234821

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C7-H7-I-O

MOLECULAR WEIGHT :: 234.04

WISWESSER LINE NOTATION :: Q1R CI

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 750 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 67,1154,1978

Safety Information

Personal Protective Equipment	Eyeshields;Gloves
Hazard Codes	Xi: Irritant;
Risk Phrases	R36/37/38
Safety Phrases	S24/25
RIDADR	NONH for all modes of transport
WGK Germany	3
RTECS	DO8318000
HS Code	2906299090

Customs

HS Code	2906299090
Summary	2906299090 other aromatic alcohols。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

Articles4

Dendritic metalloporphyrins with a distal H-bond donor as mimics of haemoglobin.

Org. Biomol. Chem. 1(7) , 1090-93, (2003)

We report the synthesis of iron(II) porphyrins functionalised with first- and second-generation dendrons as mimics of haemoglobin. The porphyrin core bears an ethynyl linker pointing towards the centr...

Radiolabeled guanine derivatives for the in vivo mapping of O(6)-alkylguanine-DNA alkyltransferase: 6-(4-[(18)F]Fluoro-benzyloxy)-9H-purin-2-ylamine and 6-(3-[(131)I]Iodo-benzyloxy)-9H-purin-2-ylamine.

Bioconjug. Chem. 11(6) , 868-75, (2000)

Two radiolabeled analogues of 6-benzyloxy-9H-purin-2-ylamine (O(6)-benzylguanine; BG) potentially useful in the in vivo mapping of O(6)-alkylguanine-DNA alkyltransferase (AGT) were synthesized. Fluori...

Direct synthesis of unprotected phenols using palladium-catalysed cross coupling reactions of functionalised organozinc reagents.

Org. Biomol. Chem. 2(1) , 110-13, (2004)

Palladium-catalysed reaction of unprotected 2-, 3-, and 4-iodophenols with a range of amino acid derived organozinc reagents (not used in excess) gives the expected products in good to excellent yield...

Synonyms

EINECS 260-744-9

MFCD00004635

(3-iodophenyl)methanol

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