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AG0071W5

Name: IPA 3
Brand: Angene Chemical
SKU: AG0071W5

42521-82-4 | IPA 3

Chemical structure of IPA 3, CAS 42521-82-4

AG0071W5

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CAS Number	42521-82-4
Catalog Number	AG0071W5(AGN-PC-0JS9UR)
Chemical Name	IPA 3
IUPAC Name	1-[(2-hydroxynaphthalen-1-yl)disulfanyl]naphthalen-2-ol
InChI	InChI=1S/C20H14O2S2/c21-17-11-9-13-5-1-3-7-15(13)19(17)23-24-20-16-8-4-2-6-14(16)10-12-18(20)22/h1-12,21-22H
InChI Key	RFAXLXKIAKIUDT-UHFFFAOYSA-N
MDL Number	MFCD17292545
Molecular Formula	C20H14O2S2
Molecular Weight	350.4540
SMILES	OC1=CC=C2C=CC=CC2=C1SSC3=C4C=CC=CC4=CC=C3O
UNII	3XFG6MQ9G2
Synonyms	IPA-3, 42521-82-4, IPA 3, 1,1'-Dithiodi-2-naphthol, UNII-3XFG6MQ9G2, Bis(2-hydroxy-1-naphthyl) disulfide, 3XFG6MQ9G2, 1,1'-Dithiodi-2-naphthtol, CHEMBL472940, 1-[(2-hydroxynaphthalen-1-yl)disulfanyl]naphthalen-2-ol, 1,1'-disulfanediylbis(naphthalen-2-ol), 1-[(2-hydroxynaphthyl)disulfanyl]naphthalen-2-ol, 2-Naphthol, 1,1'-dithiodi-, 1,1'-disulfanediyldinaphthalen-2-ol, AC1LAV4U, IPA3, dihydroxydinaphthyldisulphide, MLS006011676, GTPL8940, SCHEMBL4907161, CHEBI:95062, CTK8G0340, DTXSID70195311, CHEBI:101355, HMS3229J05, HMS3263P06, HMS3653G03, HMS3678C17, ZINC1957909, Tox21_501272, 2478AH, BDBM50112354, MFCD00388917, s7093, SBB083480, AKOS001589606, CCG-222576, CS-1432, LP01272, MCULE-1253920679, 1,1'-disulfanediyldi(naphthalen-2-ol), IPA-3, >=95% (HPLC), powder, KS-0000182U, NCGC00186047-01, NCGC00186047-02, NCGC00261957-01, HY-15663, SMR001456562, AB0165945, p21-Activated Kinase Inhibitor III, IPA-3, ST50133503, SW220299-1, W-5106, 1-[(2-hydroxy-1-naphthyl)disulfanyl]-2-naphthol, 1-(2-hydroxynaphthalen-1-yl)disulfanylnaphthalen-2-ol, F0400-0044, 1,1 inverted exclamation marka-Disulfanediyldinaphthalen-2-ol, 2-Naphthalenol, 1,1'-dithiobis-, C20H14O2S2, CID521106, ZINC01957909, B2169,

Complexity	380
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	350.044g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	350.45g/mol
Monoisotopic Mass	350.044g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	91.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H318-H410
Packing Group	Ⅲ
Precautionary statements	P273-P280-P305+P351+P338-P501
UN Code	UN 3077

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CERTIFICATE OF ANALYSIS

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited