(2,4-Difluorophenyl)thiourea

• CAS: 175277-76-6
• Catalog Number: ACM175277766
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 188.20
• Molecular Formula: C₇H₆FNO₂
• Synonyms: MLS000835023, (2,4-Difluorophenyl)thiourea, 654841_ALDRICH, N-(2,4-difluorophenyl)thiourea, NSC370368, SPB 06633, ZINC00127105, CID2734207, SMR000461639, 175277-76-6
• IUPAC Name: (2,4-difluorophenyl)thiourea
• Canonical SMILES: C1=CC(=C(C=C1F)F)NC(=S)N
• InChI Key: DZZSKQFBAGZNSH-UHFFFAOYSA-N
• Boiling Point: 138ºC(15 torr)
• Melting Point: 163-166ºC
• Flash Point: 103.3ºC
• Density: 1.493g/cm³
• Appearance: cream crystals
• Exact Mass: 188.02200
• Hazard Statements: H315-H319-H335
• H-Bond Acceptor: 2
• H-Bond Donor: 2
• RIDADR: NONH for all modes of transport
• Safety Description: S36/37
• Symbol: GHS07
• WGK Germany: 3

Custom Q&A

What is the molecular formula of (2,4-Difluorophenyl)thiourea?

The molecular formula is C7H6F2N2S.

What is the molecular weight of (2,4-Difluorophenyl)thiourea?

The molecular weight is 188.20 g/mol.

What is the IUPAC name of (2,4-Difluorophenyl)thiourea?

The IUPAC name is (2,4-difluorophenyl)thiourea.

What is the InChI of (2,4-Difluorophenyl)thiourea?

The InChI is InChI=1S/C7H6F2N2S/c8-4-1-2-6(5(9)3-4)11-7(10)12/h1-3H,(H3,10,11,12).

How many hydrogen bond donor counts does (2,4-Difluorophenyl)thiourea have?

It has 2 hydrogen bond donor counts.

What is the XLogP3 value of (2,4-Difluorophenyl)thiourea?

The XLogP3 value is 1.4.

What is the exact mass of (2,4-Difluorophenyl)thiourea?

The exact mass is 188.02197570 g/mol.

How many rotatable bond counts does (2,4-Difluorophenyl)thiourea have?

It has 1 rotatable bond count.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the CAS number of (2,4-Difluorophenyl)thiourea?

The CAS number is 175277-76-6.