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3-Ketocarbofuran phenol

3-Ketocarbofuran phenol structure

CAS No:
17781-16-7
Formula:
C10H10O3
Chemical Name:
3-Ketocarbofuran phenol
Synonyms:
3(2H)-Benzofuranone,7-hydroxy-2,2-dimethyl-;7-Hydroxy-2,2-dimethyl-3(2H)-benzofuranone;2,3-Dihydro-2,2-dimethyl-3-keto-7-hydroxybenzofuran;2,3-Dihydro-7-hydroxy-2,2-dimethyl-3-oxobenzofuran;3-Ketocarbofuran phenol;2,3-Dihydro-2,2-dimethyl-3-oxo-7-benzofuranol;7-Hydroxy-2,2-dimethylbenzofuran-3-one;2,3-Dihydro-7-hydroxy-2,2-dimethyl-3-ketobenzofuran;2,2-Dimethyl-3-oxo-2,3-dihydro-1-benzofuran-7-ol
Categories:
Analytical Chemistry > Standard

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3-Ketocarbofuran phenol Basic Attributes

Molecular Weight：

178.2

Exact Mass：

178.18

DSSTox ID：

DTXSID1041556

HScode：

2932999099

Characteristics

PSA：

46.5

XLogP3：

2.05

Density：

1.2±0.1 g/cm3

Boiling Point：

314.5±42.0 °C at 760 mmHg

Flash Point：

127.3±21.4 °C

Refractive Index：

1.568

Vapor Pressure：

0.000251mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1(b)

Transport codes：

2757

hazard class code：

36/37/38-51/53

safety instructions：

26-36/37-61

Marks：

Xi,N

Precautionary statement(s)：

P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P391, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|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|Aggregated GHS information provided by 130 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:178.18
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:178.062994177
Monoisotopic Mass:178.062994177
Topological Polar Surface Area:46.5
Heavy Atom Count:13
Complexity:234
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes