(2-Fluorophenyl)thiourea, 95%

Name: (2-Fluorophenyl)thiourea
Brand: Chempure

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CAS Number

656-32-6

Molecular Weight

170.21

Formula

C7H7FN2S

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IUPAC name	(2-fluorophenyl)thiourea
canonical smiles	C1=CC=C(C(=C1)NC(=S)N)F
inchi	InChI=1S/C7H7FN2S/c8-5-3-1-2-4-6(5)10-7(9)11/h1-4H,(H3,9,10,11)
inchi key	WYVZQQOFMQRNPF-UHFFFAOYSA-N
molecular formula	C7H7FN2S
synonyms	656-32-6 1-(2-fluorophenyl)thiourea (2-fluorophenyl)thiourea 1-(2-Fluorophenyl)-2-thiourea Thiourea, (2-fluorophenyl)-

Computed Properties

Molecular Weight:	170.21 g/mol
XLogP3:	1.5
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	1
Exact Mass:	170.03139757 g/mol
Monoisotopic Mass:	170.03139757 g/mol
Topological Polar Surface Area:	70.1 Å²
Heavy Atom Count:	11
Formal Charge:	0
Complexity:	151
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

hazard signal	Danger
hazard classes and categories	Acute Tox. 3 (85.71%) Skin Irrit. 2 (28.57%) Eye Irrit. 2A (28.57%) STOT SE 3 (42.86%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H301 (85.71%): Toxic if swallowed [Danger Acute toxicity, oral] H315 (28.57%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (28.57%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (42.86%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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Product No: AQ5955

(2-Fluorophenyl)thiourea, 95%

Product No: AQ5955

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Product No: AQ5955

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NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?