(difluoromethyl)(imino)phenyl-lambda6-sulfanone, 95%

Name: (difluoromethyl)(imino)phenyl-lambda6-sulfanone
Brand: Chempure

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CAS Number

1333375-53-3

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About this item

IUPAC name	difluoromethyl-imino-oxo-phenyl-λ6-sulfane
inchi	InChI=1S/C7H7F2NOS/c8-7(9)12(10,11)6-4-2-1-3-5-6/h1-5,7,10H
inchi key	OVTMRPQANBHQPY-UHFFFAOYSA-N
molecular formula	C7H7F2NOS
synonyms	1333375-53-3 (DIFLUOROMETHYL)(IMINO)PHENYL-LAMBDA6-SULFANONE S-(Difluoromethyl)-S-phenylsulfoximine difluoromethyl-imino-oxo-phenyl-lambda6-sulfane (S-(Difluoromethyl)sulfonimidoyl)benzene

Computed Properties

Molecular Weight:	191.20 g/mol
XLogP3:	3.4
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	4
Rotatable Bond Count:	2
Exact Mass:	191.02164134 g/mol
Monoisotopic Mass:	191.02164134 g/mol
Topological Polar Surface Area:	49.3 Å²
Heavy Atom Count:	12
Formal Charge:	0
Complexity:	242
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, P317, 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] H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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Product No: BG3002

(difluoromethyl)(imino)phenyl-lambda6-sulfanone, 95%

Product No: BG3002

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NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

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