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3-THIAZOL-2-YL-BENZOICACID

3-THIAZOL-2-YL-BENZOICACID structure

CAS No:
847956-27-8
Formula:
C10H7NO2S
Chemical Name:
3-THIAZOL-2-YL-BENZOICACID
Synonyms:
3-(1,3-Thiazol-2-yl)benzoic acid;3-THIAZOL-2-YL-BENZOIC ACID;3-(1,3-Thiazol-2-yl)benzoic acid 97%;3-(3-(Methoxycarbonyl)thiazol-2-yl)benzoic acid;3-(5-(Ethoxycarbonyl)thiazol-2-yl)benzoic acid;3-(5-Formylthiazol-2-yl)benzoic acid;3-(5-Nitrothiazol-2-yl)benzoic acid;3-(1,3-Thiazol-2-yl)benzoic acid, 97+%

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3-THIAZOL-2-YL-BENZOICACID Basic Attributes

Molecular Weight：

205.23

Exact Mass：

205.01974964

DSSTox ID：

DTXSID10610558

Characteristics

Density：

1.368±0.06 g/cm3

Melting Point：

160.5 °C

Boiling Point：

423.4±47.0 °C(Predicted)

PKA：

3.85±0.10

Safety Information

hazard class code：

Marks：

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P311, P312, P321, P322, P330, P361, P363, 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:205.23
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:205.01974964
Monoisotopic Mass:205.01974964
Topological Polar Surface Area:78.4
Heavy Atom Count:14
Complexity:222
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-THIAZOL-2-YL-BENZOICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

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