 Home > Encyclopedia > 2-(2-THIENYL)BENZOICACID

2-(2-THIENYL)BENZOICACID

2-(2-THIENYL)BENZOICACID structure

CAS No:
6072-49-7
Formula:
C11H8O2S
Chemical Name:
2-(2-THIENYL)BENZOICACID
Synonyms:
AKOS BAR-0195;RARECHEM AL BE 1415;2-THIEN-2-YLBENZOIC ACID;2-(2-THIENYL)BENZOIC ACID;2-(2-Carboxyphenyl)thiophene;2-THIOPHEN-2-YL-BENZOIC ACID
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

Request for Quotation

2-(2-THIENYL)BENZOICACID Basic Attributes

Molecular Weight：

204.25

Exact Mass：

204.02500

DSSTox ID：

DTXSID40408384

HScode：

2934999090

Characteristics

PSA：

65.54000

XLogP3：

3.11330

Density：

1.303g/cm3

Melting Point：

92 °C

Boiling Point：

342.1ºC at 760 mmHg

Flash Point：

160.7ºC

Refractive Index：

1.635

Safety Information

Hazard category：

IRRITANT

hazard class code：

22-36

safety instructions：

Marks：

Hazard note：

Harmful

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:204.25
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:204.02450067
Monoisotopic Mass:204.02450067
Topological Polar Surface Area:65.5
Heavy Atom Count:14
Complexity:217
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes