AG0035ML

761-01-3 | Sulfur Trioxide Triethylamine Complex

AG0035ML

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CAS Number	761-01-3
Catalog Number	AG0035ML(AGN-PC-0WAJU2)
Chemical Name	Sulfur Trioxide Triethylamine Complex
IUPAC Name	N,N-diethylethanamine;sulfur trioxide
InChI	InChI=1S/C6H15N.O3S/c1-4-7(5-2)6-3;1-4(2)3/h4-6H2,1-3H3;
InChI Key	YYHPEVZFVMVUNJ-UHFFFAOYSA-N
MDL Number	MFCD00043315
Molecular Formula	C6H15NO3S
Molecular Weight	181.2532
SMILES	O=S(=O)=O.CCN(CC)CC
Synonyms	761-01-3, SULFUR TRIOXIDE-TRIETHYLAMINE COMPLEX, Sulfur trioxide triethylamine complex, Sulfur Trioxide - Triethylamine Complex, N,N-diethylethanamine; sulfur trioxide, NSC8168, AC1L5BLP, AC1Q6YFE, Et3N.SO3, triethylamine sulphur trioxide, SCHEMBL284131, CTK2H9302, DTXSID90278539, YYHPEVZFVMVUNJ-UHFFFAOYSA-N, NSC 8168, NSC-8168, NSC68185, Triethylamine sulfur trioxide complex, MFCD00043315, NSC 68185, NSC-68185, FT-0698941, N,N-diethylethanamine - oxosulfane dioxide (1:1), Sulfur trioxide triethylamine complex, technical, >=95% sulfur basis (ICP), CID222301, SULFUR TRIOXIDE; TRIETHYLAMINE, Triethylamine - Sulfur Trioxide Complex, T2136,

Complexity	87.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.077g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	181.25g/mol
Monoisotopic Mass	181.077g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅱ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 3261

Certificate of Analysis

Lot Number