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Home > Encyclopedia > 5-Chloro-3-methylbenzo[b]thiophene

5-Chloro-3-methylbenzo[b]thiophene

5-Chloro-3-methylbenzo[b]thiophene structure

5-Chloro-3-methylbenzo[b]thiophene 

structure
  • CAS No:

    19404-18-3

  • Formula:

    C9H7ClS

  • Chemical Name:

    5-Chloro-3-methylbenzo[b]thiophene

  • Synonyms:

    Benzo[b]thiophene,5-chloro-3-methyl-;5-Chloro-3-methylbenzo[b]thiophene;5-Chloro-3-methylbenzothiophene;NSC 248678

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

Description

White to light yellow solid

5-Chloro-3-methylbenzo[b]thiophene Basic Attributes

182.67

182.67

606-305-0

248678

DTXSID40311985

29309090

Characteristics

28.2

5.43

1.293±0.06 g/cm3(Predicted)

33 °C

92-93 °C @ Press: 0.3 Torr

163.1±8.5 °C

1.661

0.00641mmHg at 25°C

Safety Information

36/37/38-22

26-37/39

Xi,Xn

Irritant

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:182.67
XLogP3:3.9
Hydrogen Bond Acceptor Count:1
Exact Mass:181.9956991
Monoisotopic Mass:181.9956991
Topological Polar Surface Area:28.2
Heavy Atom Count:11
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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