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1,2-DIMETHYL-1H-INDOLE-3-CARBOXALDEHYDE

1,2-DIMETHYL-1H-INDOLE-3-CARBOXALDEHYDE structure

CAS No:
38292-40-9
Formula:
C11H11NO
Chemical Name:
1,2-DIMETHYL-1H-INDOLE-3-CARBOXALDEHYDE
Synonyms:
TIMTEC-BB SBB010161;1,2-DIMETHYL-1H-INDOLE-3-CARBOXALDEHYDE;1,2-DIMETHYL-1H-INDOLE-3-CARBOXYALDEHYDE;1,2-DIMETHYL-1H-INDOLE-3-CARBALDEHYDE;1,2-dimethyl-1H-indole-3-carbaldehyde(SALTDATA: 0.1H2O);1,2-Dimethyl-3-formyl-1H-indole;1,2-Dimethyl-3-formylindole;1,2-dimethyl-3-indolecarboxaldehyde
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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1,2-DIMETHYL-1H-INDOLE-3-CARBOXALDEHYDE Basic Attributes

Molecular Weight：

173.21

Exact Mass：

173.084063974 g/mol

DSSTox ID：

DTXSID20344736

HScode：

2933990090

Characteristics

PSA：

22.00000

XLogP3：

2.29920

Density：

1.09g/cm3

Melting Point：

127-129

Boiling Point：

334.1ºC

Flash Point：

155.9ºC

Refractive Index：

1.575

Safety Information

Hazard category：

IRRITANT

hazard class code：

safety instructions：

26-39

Marks：

GHS Classification：

|Warning|H302 (66.67%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:173.21
XLogP3:1.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:173.084063974
Monoisotopic Mass:173.084063974
Topological Polar Surface Area:22
Heavy Atom Count:13
Complexity:204
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,2-DIMETHYL-1H-INDOLE-3-CARBOXALDEHYDE

Basic Attributes
Characteristics
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Computed Properties
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