AG0033Y4

55368-42-8 | 4-Bromobenzamidine hydrochloride hydrate

AG0033Y4

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CAS Number	55368-42-8
Catalog Number	AG0033Y4(AGN-PC-0SJ1FQ)
Chemical Name	4-Bromobenzamidine hydrochloride hydrate
IUPAC Name	4-bromobenzenecarboximidamide;hydrochloride
InChI	InChI=1S/C7H7BrN2.ClH/c8-6-3-1-5(2-4-6)7(9)10;/h1-4H,(H3,9,10);1H
InChI Key	IMTHEBSPHHMJOJ-UHFFFAOYSA-N
MDL Number	MFCD00009808
Molecular Formula	C7H8BrClN2
Molecular Weight	235.5088
SMILES	N=C(N)c1ccc(cc1)Br.[H]Cl
Synonyms	4-Bromobenzamidine hydrochloride, 55368-42-8, 4-bromobenzimidamide hydrochloride, 4-Bromo-benzamidine hydrochloride, 4-Bromobenzamidine HCl, 4-Bromobenzenecarboximidamide hydrochloride, MFCD00464967, AK-89169, EN300-82342, Benzenecarboximidamide, 4-bromo-, monohydrochloride, 4-BROMOBENZENE-1-CARBOXIMIDAMIDE HYDROCHLORIDE, 4-bromobenzenecarboxamidine, chloride, 4-Bromobenzamidinehydrochloride, 4-Bromobenzenecarboximidamide Hydrochloride, 4-Bromobenzimidamide Hydrochloride, 4-Bromobenzimidamide, HCl, KSC493E3F, SCHEMBL982825, CTK3J3232, IMTHEBSPHHMJOJ-UHFFFAOYSA-N, 4-Bromo-benzamidine hydrochloride, 4-bromobenzamidine hydrogen chloride, BCP26903, KS-00000EM7, ZX-AT019485, ZX-CM003993, ANW-52518, FC0686, SBB055497, AKOS008122128, AB06234, CS-W002631, MCULE-1928699665, OR59369, RP05696, RTR-019521, TRA0005055, ACM22265367, AC-23331, AM804038, AN-40397, DA-17012, SC-41214, SY014927, TS-01523, AB0001385, AX8029043, ST2405677, TR-019521, 4CH-018842, B4161, FT-0083674, FT-0647435, ST50949976, X4734, 68B428, A15645, Q-9076, MFCD00464967 (97+%), I01-7466, J-514802, Z1263602346, 4-Bromobenzamidine, C7H7BrN2.HCl, 1-(3-azetidinyl)-1H-pyrazole, ACN-032238, C2205, 4-Bromo-benzamidine hydrochloride, 99% - 1G 1g, 22265-36-7,

Complexity	128
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.956g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	235.509g/mol
Monoisotopic Mass	233.956g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	49.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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