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1,7-dimethyl-1H-indole-2-carboxylicacid

1,7-dimethyl-1H-indole-2-carboxylicacid structure

CAS No:
858233-18-8
Formula:
C11H11NO2
Chemical Name:
1,7-dimethyl-1H-indole-2-carboxylicacid
Synonyms:
1,7-dimethyl-1H-indole-2-carboxylic acid;1,7-dimethyl-1H-indole-2-carboxylic acid(SALTDATA: FREE);1H-Indole-2-carboxylic acid, 1,7-dimethyl-

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1,7-dimethyl-1H-indole-2-carboxylicacid Basic Attributes

Molecular Weight：

189.21

Exact Mass：

189.078978594

DSSTox ID：

DTXSID80649234

HScode：

2933990090

Characteristics

PSA：

42.23000

XLogP3：

2.18490

Density：

1.21±0.1 g/cm3

Melting Point：

218.5 °C (decomp)

Boiling Point：

399.1±22.0 °C(Predicted)

Flash Point：

195.2ºC

Refractive Index：

1.599

PKA：

4.24±0.30

Safety Information

Hazard category：

IRRITANT

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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:189.21
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:189.078978594
Monoisotopic Mass:189.078978594
Topological Polar Surface Area:42.2
Heavy Atom Count:14
Complexity:241
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: cobalt sulfide; magnesium pyrophosphate formula; acetic acid formula; dichloromethane msds; 2-methyl-2-butene; catechol

Guide of 1,7-dimethyl-1H-indole-2-carboxylicacid

Basic Attributes
Characteristics
Safety Information
Computed Properties

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