AG001MDJ

15015-57-3 | Phenol, 4,4'-dithiobis-

AG001MDJ

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CAS Number	15015-57-3
Catalog Number	AG001MDJ(AGN-PC-0JP53E)
Chemical Name	Phenol, 4,4'-dithiobis-
IUPAC Name	4-[(4-hydroxyphenyl)disulfanyl]phenol
InChI	InChI=1S/C12H10O2S2/c13-9-1-5-11(6-2-9)15-16-12-7-3-10(14)4-8-12/h1-8,13-14H
InChI Key	XGKGITBBMXTKTE-UHFFFAOYSA-N
MDL Number	MFCD00020164
Molecular Formula	C12H10O2S2
Molecular Weight	250.3366
NSC Number	132570
SMILES	OC1=CC=C(C=C1)SSC1=CC=C(C=C1)O
Synonyms	15015-57-3, Bis(4-hydroxyphenyl)disulfide, phenol, 4,4'-dithiobis-, Bis(4-hydroxyphenyl) Disulfide, 4,4'-disulfanediyldiphenol, 4,4'-Dihydroxy diphenyl disulfide, 4,4'-Dithiodiphenol, 4-[(4-hydroxyphenyl)disulfanyl]phenol, 4,4'-Dihydroxydiphenyl Disulfide, 4,4 -Disulfanediyldiphenol, NSC132570, 4,4'-dithiobisphenol, PubChem15317, 4-hydroxyphenyldisulfide, AC1L5SSD, ACMC-209d3x, AC1Q7EB0, bis(p-hydroxyphenyl)disulfide, di(4-hydroxyphenyl)-disulfide, SCHEMBL901003, bis(4-hydroxyphenyl)disulphide, CHEMBL558284, CTK0I2090, DTXSID10299766, XGKGITBBMXTKTE-UHFFFAOYSA-N, HMS1577A18, ZINC281112, CCG-2119, ANW-21259, MFCD00020164, STL323480, AKOS022140244, MCULE-1510134955, NSC-132570, QC-7386, RP28907, VZ35243, AS-13448, I311, ZB010117, TC-110004, TL8006852, B3827, FT-0732159, KS-00001220, B18100, M-1597, A809013, J-519876, I14-57746, S(Sc1ccc(O)cc1)c2ccc(O)cc2, C12H10O2S2, AR-1L0328, CID280665, 81759-25-3,

Complexity	175
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	250.012g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	250.33g/mol
Monoisotopic Mass	250.012g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	91.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

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