AG0037P7

16796-52-4 | 3-Bromobenzimidamide, HCl

AG0037P7

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CAS Number	16796-52-4
Catalog Number	AG0037P7(AGN-PC-0Q95NZ)
Chemical Name	3-Bromobenzimidamide, HCl
IUPAC Name	3-bromobenzenecarboximidamide;hydrochloride
InChI	InChI=1S/C7H7BrN2.ClH/c8-6-3-1-2-5(4-6)7(9)10;/h1-4H,(H3,9,10);1H
InChI Key	XIZFRYIWRFNILW-UHFFFAOYSA-N
MDL Number	MFCD04114439
Molecular Formula	C7H8BrClN2
Molecular Weight	235.5088
SMILES	Brc1cccc(c1)C(=N)N.Cl
Synonyms	3-Bromobenzamidine hydrochloride, 16796-52-4, 3-bromobenzimidamide hydrochloride, 3-bromo-benzamidine hydrochloride, 3-BROMOBENZENE-1-CARBOXIMIDAMIDE HYDROCHLORIDE, 3-bromobenzenecarboximidamide hydrochloride, AK-16801-7, Benzenecarboximidamide, 3-bromo-, monohydrochloride, 3-bromobenzenecarboxamidine, chloride, C7H8BrClN2, 3-BROMOBENZAMIDINE HCL, SCHEMBL3764471, CTK8B2877, 3-BROMOBENZIMIDAMIDE, HCL, DTXSID70480476, XIZFRYIWRFNILW-UHFFFAOYSA-N, CS-D1558, EBD55132, KS-00000LL0, ANW-41235, FC0687, MFCD04114439, SBB055496, AKOS015843944, AB18330, CB-3001, HCH0021349, LS10543, MCULE-6297742926, 3-aa+/-(1/2)(1/4)xessNIEaNI, BC005204, CC-14498, SC-40984, SY028768, TS-01522, AB0001388, AX8004735, DB-001503, ST2410578, TR-007288, 3-bromanylbenzenecarboximidamide hydrochloride, 4CH-014228, BR-16801-7, C2159, FT-0637430, ST50949975, W3660, MFCD04114439 (95%), EN300-156238, S-2584, 796B524, A810926, C-13919, I01-7693, Z1741973354, 3-Bromo-benzamidine, 3-Bromobenzimidamide, 3-bromobenzenecarboximidamide, 3-bromobenzene-1-carboximidamide, ACN-037887, 26157-85-7,

Complexity	136
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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