1H-Benzimidazole-2-methanol,6-chloro

Modify Date: 2025-08-27 18:06:12

1H-Benzimidazole-2-methanol,6-chloro structure	Common Name	1H-Benzimidazole-2-methanol,6-chloro
	CAS Number	6953-65-7	Molecular Weight	182.60700
	Density	1.51g/cm3	Boiling Point	443.9ºC at 760 mmHg
	Molecular Formula	C₈H₇ClN₂O	Melting Point	206-208°C
	MSDS	N/A	Flash Point	222.2ºC

Name	(6-Chloro-1H-benzo[d]imidazol-2-yl)methanol
Synonym	More Synonyms

Density	1.51g/cm3
Boiling Point	443.9ºC at 760 mmHg
Melting Point	206-208°C
Molecular Formula	C₈H₇ClN₂O
Molecular Weight	182.60700
Flash Point	222.2ºC
Exact Mass	182.02500
PSA	48.91000
LogP	1.70860
Index of Refraction	1.724
InChIKey	NIWRFQPRPJVQLO-UHFFFAOYSA-N
SMILES	OCc1nc2ccc(Cl)cc2[nH]1
Storage condition	2-8°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DD9050000

CHEMICAL NAME :: 2-Benzimidazolemethanol, 5-chloro-

CAS REGISTRY NUMBER :: 6953-65-7

BEILSTEIN REFERENCE NO. :: 0005727

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C8-H7-Cl-N2-O

MOLECULAR WEIGHT :: 182.62

WISWESSER LINE NOTATION :: T56 BM DNJ C1Q GG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 56 mg/kg

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

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#04466

Hazard Codes	Xi
RIDADR	NONH for all modes of transport
HS Code	2933990090

Glycolic acid

CAS#:79-14-1

4-Chlorobenzene...

CAS#:95-83-0

~80%

1H-Benzimidazol...

CAS#:6953-65-7

Literature: JANSSEN RandD IRELAND; TAHRI, Abdellah; VENDEVILLE, Sandrine Marie Helene; JONCKERS, Tim Hugo Maria; RABOISSON, Pierre Jean-Marie Bernard; HU, Lili; DEMIN, Samuël Dominique; COOYMANS, Ludwig Paul Patent: WO2014/60411 A1, 2014 ; Location in patent: Page/Page column 58 ;

Precursor 2
CAS#:79-14-1 Glycolic acid CAS#:95-83-0 4-Chlorobenzene...
DownStream 2
CAS#:39811-14-8 6-CHLORO-1H-BEN... CAS#:380177-22-0 1H-Benzimidazol...

HS Code	2933990090
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS

Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN

Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN

Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN

Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay

Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.

Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity

Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity

Name: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity

Name: qHTS of TDP-43 Inhibitors: NCGC Sytravon Library Screen
Source: NCGC
External Id: tdp43-p2-repeat

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