AG00DHR4

441771-60-4 | 3,6,9,12,15,18-Hexaoxanonadecane-1-thiol

AG00DHR4

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CAS Number	441771-60-4
Catalog Number	AG00DHR4(AGN-PC-09RMNW)
Chemical Name	3,6,9,12,15,18-Hexaoxanonadecane-1-thiol
IUPAC Name	2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanethiol
InChI	InChI=1S/C13H28O6S/c1-14-2-3-15-4-5-16-6-7-17-8-9-18-10-11-19-12-13-20/h20H,2-13H2,1H3
InChI Key	FCNSUDTWFXNQBG-UHFFFAOYSA-N
MDL Number	MFCD16619311
Molecular Formula	C13H28O6S
Molecular Weight	312.4228
SMILES	COCCOCCOCCOCCOCCOCCS
Synonyms	441771-60-4, 2,5,8,11,14,17-Hexaoxanonadecane-19-thiol, m-PEG6-thiol, 3,6,9,12,15,18-HEXAOXANONADECANE-1-THIOL, mPEG6-SH, mPEG6-thiol, mPEG6-HS, BIPG1649, SCHEMBL17336142, CTK1D4896, DTXSID00694786, ZINC90556286, AKOS027320764, AN-28375, BP-22084, 771H604, 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanethiol,

Complexity	173
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	312.161g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	312.421g/mol
Monoisotopic Mass	312.161g/mol
Rotatable Bond Count	17
Topological Polar Surface Area	56.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

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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