1-[1-(1-Benzothiophen-2-yl)ethyl]-1-hydroxyurea | CAS No. 111406-87-2

1-[1-(1-Benzothiophen-2-yl)ethyl]-1-hydroxyurea

Basic Information

CAS Number

111406-87-2

Molecular Formula

C11H12N2O2S

Molecular Weight

236.3 g/mol

AD

Basic Physical Properties

Physical State

Powder

Melting Point

156-158°C

Boiling Point

449.4°C at 760 mmHg

Density

1.401 g/cm3

Flash Point

225.6±29.3 °C

Solubility

DMSO: ≥20mg/mL at ~60°C (warm up to 60 C for 5min)

Refractive Index

1.704

CC(C1=CC2=CC=CC=C2S1)N(C(=O)N)O

InChI

InChI=1S/C11H12N2O2S/c1-7(13(15)11(12)14)10-6-8-4-2-3-5-9(8)16-10/h2-7,15H,1H3,(H2,12,14)

InChIKey

MWLSOWXNZPKENC-UHFFFAOYSA-N

LogP

2.7322000000000015

Topological Polar Surface Area

66.56 Ų

Hydrogen Bond Donor/Acceptor

3 / 4

Complexity

275

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

  • Zyflo (TN)
  • Z1546610483
  • MLS000759510
  • ZILEUTON [WHO-DD]
  • Zyflo Filmtab
  • BDBM50000541
  • Urea, N-(1-benzo[b]thien-2-ylethyl)-N-hydroxy-
  • CHEBI:10112
  • (+/-)-N-hydroxy-N-(1-benzo[b]thien-2-ylethyl)urea
  • ZILEUTON [MART.]
  • ZILEUTON [INN]
  • AC-13198
  • EN300-123022
  • NS00023571
  • SY102131
  • AB00639921_11
  • MRF-0000030
  • Zileuton- Bio-X
  • NSC759277
  • N-[1-(benzo[b]thiophen-2-yl)ethyl]-N-hydroxyurea
  • AMY12540
  • 1-[1-(1-benzothien-2-yl)ethyl]-1-hydroxyurea
  • SR-01000759349-5
  • N-(1-Benzo(b)thien-2-ylethyl)-N-hydroxyurea
  • HMS3654J08
  • AB00639921-09
  • HMS3872F13
  • AB00639921_10
  • DTXCID003752
  • NCGC00255046-01
  • Zileutonum

MDL Number

MFCD00866097

Customs Code

2934999090

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