AG003HXB

22580-55-8 | 2-Pyrrolidone hydrotribromide

AG003HXB

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CAS Number	22580-55-8
Catalog Number	AG003HXB(AGN-PC-0WAK7K)
Chemical Name	2-Pyrrolidone hydrotribromide
InChI	InChI=1S/C4H7NO.Br3/c6-4-2-1-3-5-4;1-3-2/h1-3H2,(H,5,6);/q;-1
InChI Key	OTYIQJFSTDUAJR-UHFFFAOYSA-N
MDL Number	MFCD00082241
Molecular Formula	C4H7Br3NO
Molecular Weight	324.8165
SMILES	O=C1NCCC1.Br[Br]Br
Synonyms	Pyrrolidone hydrotribromide, 22580-55-8, 2-Pyrrolidinone hydrotribromide, pyrrolidonehydrotribromide, 2-PYRROLIDONE HYDROTRIBROMIDE, pyrrolidinone hydrotribromide, PubChem19110, pyrolidone hydrotribromide, pyrolidinone hydrotribromide, C12H22Br3N3O3, PHT, Pyrrolidone hydrotribromide, OTYIQJFSTDUAJR-UHFFFAOYSA-N, 2??-tribromane; pyrrolidin-2-one, BCP15175, MFCD00082241, AKOS032953711, AS-19243, BC004426, SC-85210, FT-0613404, X5932, pyrrolidin-2-one compound with 2l3-tribromane (1:1), C4H7NO.1/3Br3H, C4-H7-N-O.1/3Br3-H, EINECS 245-100-7, ACN-043124, Pyrrolidone hydrotribromide, 97% - 5G 5g, Hydrogen tribromide, compound with pyrrolidin-2-one (1:3), PHT, 52215-12-0,

Complexity	69.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	323.806g/mol
Formal Charge	-1
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	324.818g/mol
Monoisotopic Mass	321.808g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number