tert-butyl(imino)methyl-lambda6-sulfanone, 95%

Name: tert-butyl(imino)methyl-lambda6-sulfanone
Brand: Chempure

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CAS Number

1085526-21-1

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About this item

IUPAC name	tert-butyl-imino-methyl-oxo-λ6-sulfane
inchi	InChI=1S/C5H13NOS/c1-5(2,3)8(4,6)7/h6H,1-4H3
inchi key	ZJUMQDAODKLMFI-UHFFFAOYSA-N
molecular formula	C5H13NOS
synonyms	1085526-21-1 tert-butyl(imino)methyl-lambda6-sulfanone S-tert-Butyl-S-methylsulfoximine Tert-butyl-imino-methyl-oxo-lambda6-sulfane tert-Butyl(imino)(methyl)-l6-sulfanone

Computed Properties

Molecular Weight:	135.23 g/mol
XLogP3:	1.9
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	1
Exact Mass:	135.07178521 g/mol
Monoisotopic Mass:	135.07178521 g/mol
Topological Polar Surface Area:	49.3 Å²
Heavy Atom Count:	8
Formal Charge:	0
Complexity:	171
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

hazard signal	Warning
hazard classes and categories	Acute Tox. 4 (100%) Skin Irrit. 2 (100%) Eye Irrit. 2A (100%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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Product No: AZ4687

tert-butyl(imino)methyl-lambda6-sulfanone, 95%

Product No: AZ4687

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Product No: AZ4687

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?