AG000C5Q

1163-36-6 | 1H-Benzimidazole, 1-[(4-chlorophenyl)methyl]-2-(1-pyrrolidinylmethyl)-, hydrochloride (1:1)

AG000C5Q

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CAS Number	1163-36-6
Catalog Number	AG000C5Q(AGN-PC-080Y44)
Chemical Name	1H-Benzimidazole, 1-[(4-chlorophenyl)methyl]-2-(1-pyrrolidinylmethyl)-, hydrochloride (1:1)
EC Number	214-605-4
IUPAC Name	1-[(4-chlorophenyl)methyl]-2-(pyrrolidin-1-ylmethyl)benzimidazole;hydrochloride
InChI	InChI=1S/C19H20ClN3.ClH/c20-16-9-7-15(8-10-16)13-23-18-6-2-1-5-17(18)21-19(23)14-22-11-3-4-12-22;/h1-2,5-10H,3-4,11-14H2;1H
InChI Key	DNFMJYXRIMLMBZ-UHFFFAOYSA-N
MDL Number	MFCD00051435
Molecular Formula	C19H21Cl2N3
Molecular Weight	362.2961
NSC Number	759290
SMILES	ClC1=CC=C(CN2C3=C(C=CC=C3)N=C2CN4CCCC4)C=C1.[H]Cl
UNII	85W6I13D8M
Synonyms	Clemizole hydrochloride, 1163-36-6, Clemizole HCl, Clemizole (hydrochloride), Allercur, Reactrol, UNII-85W6I13D8M, Allercure hydrochloride, Clemizole hydrochloride [JAN], MLS000120342, 85W6I13D8M, SMR000058430, AL 20, EINECS 214-605-4, 1-[(4-chlorophenyl)methyl]-2-(pyrrolidin-1-ylmethyl)benzimidazole hydrochloride, DSSTox_CID_25136, DSSTox_RID_80695, DSSTox_GSID_45136, P 48, Clemizole hydrochloride (JAN), 1-p-Chlorobenzyl-2-(1-pyrrolidinyl)methylbenzimidazole hydrochloride, 1-(p-chlorobenzyl)-2-(1-pyrrolidinylmethyl)-benzimidazolmonohydrochloride, 1-[(4-Chlorophenyl)methyl]-2-(1-pyrrolidinylmethyl)-1H-benzimidazole hydrochloride, 1-p-Chlorobenzyl-pyrrolidyl-methylene-benzimidazole hydrochloride, 1-(p-Chlorobenzyl)-2-(1-pyrrolidinylmethyl)benzimidazole hydrochloride, 1-(p-Chlorobenzil)-2-pirrolidil-metil-benzimidazolo cloridato [Italian], BENZIMIDAZOLE, 1-(p-CHLOROBENZYL)-2-(1-PYRROLIDINYLMETHYL)-, MONOHYDROCHLORIDE, SR-01000000057, NCGC00015243-02, CAS-1163-36-6, Clemizole.HCl, 1-[(4-chlorophenyl)methyl]-2-(pyrrolidinylmethyl)benzimidazole, chloride, Allercur (TN), Reactrol (TN), Prestwick_116, allercurehydrochloride, AC1NSGXI, Clemizole(hydrochloride), Opera_ID_1842, MLS000028396, MLS002222168, SCHEMBL210095, DTXSID9045136, CHEBI:31409, AOB4996, EX-A346, DNFMJYXRIMLMBZ-UHFFFAOYSA-N, 1-(p-Chlorobenzil)-2-pirrolidil-metil-benzimidazolo cloridato, HMS1568N15, Pharmakon1600-01505990, BCP11344, KS-00001DL1, Tox21_110108, Tox21_500284, HY-30234A, MFCD00051435, NSC759290, SBB057808, AKOS024370943, Tox21_110108_1, CCG-213997, CS-1489, LP00284, MCULE-2180061700, NSC-759290, NCGC00015243-10, NCGC00093738-01, NCGC00093738-02, NCGC00180972-01, NCGC00260969-01, AN-48749, BC635891, Clemizole hydrochloride, >=98% (HPLC), C3468, EU-0100284, FT-0607159, ST51007033, C 5040, D01705, W-5052, 163C366, A803600, SR-01000000057-2, SR-01000000057-8, SR-01000000057-10, 1-(p-chlorobenzil)-2-pirrolidil-metil-benzimidazolocloridato, 1-p-chlorobenzyl-pyrrolidyl-methylene-benzimidazolehydrochloride, 1-(4-Chlorobenzyl)-2-(pyrrolidin-1-ylmethyl)benzimidazole Hydrochloride, 1-p-chlorobenzyl-2-[1-pyrrolidinyl]-methylbenzimidazole hydrochloride, 1-(4-Chlorobenzyl)-2-(pyrrolidin-1-ylmethyl)-1H-benzo[d]imidazole hydrochloride, 1-[(4-chlorophenyl)methyl]-2-(1-pyrrolidinylmethyl)benzimidazole hydrochloride, 1-[(4-chlorophenyl)methyl]-2-(pyrrolidin-1-ylmethyl)benzimidazole;hydrochloride, 1-[(4-Chlorophenyl)methyl]-2-(pyrrolidin-1-ylmethyl)benzoimidazole hydrochloride, 1H-Benzimidazole, 1-[(4-chlorophenyl)methyl]-2-(1-pyrrolidinylmethyl)-, hydrochloride (1:1), Clemizole, C19H20ClN3.ClH, CLEMIZOLEHYDROCHLORIDE, C19-H20-Cl-N3.Cl-H, CID5309446, 1163-36-6 (HCl), A3316, A15047, 1-p-Chlorobenzyl-2-pyrrolidylmethyl benzimidazole hydrochloride, 1-(4-Chlorobenzyl)-2-(pyrrolidin-1-ylmethyl)-1H-benzo[d]imidazole, 1-p-Chlorobenzyl-2-(1-pyrrolidinylmethyl)benzimidazole hydrochloride, 1-(4-Chlorobenzyl)-2-(pyrrolidinylmethyl)-1 3-benzimidazole hydrochloride, 1H-bencimidazol, 1-[(4-clorofenil) metil]-2-(1-pirrolidinilmetil)-, monoclorhidrato (9CI), 1H-Benzimidazol, 1-[(4-clorofenil)metil]-2-(1-pirrolidinilmetil)-, clorhidrato (1:1), 1H-Benzimidazole, 1-((4-chlorophenyl)methyl)-2-(1-pyrrolidinylmethyl)-, monohydrochloride, 1H-Benzimidazole, 1-[(4-chlorophenyl)methyl]-2-(1-pyrrolidinylmethyl)-, monohydrochloride, Benzimidazole 1-(p-chlorobenzyl)-2-(1-pyrrolidinylmethyl)-monohydrochloride (8CI), 1H-Benzimidazole 1-[(4-chlorophenyl)methyl]-2-(1-pyrrolidinylmethyl)-monohydrochloride (9CI), 442-52-4, P48,

Complexity	377
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	361.111g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	362.298g/mol
Monoisotopic Mass	361.111g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	21.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P301+P312+P330
UN Code

Certificate of Analysis

Lot Number