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3-Cyano-6-isopropylchromone

3-Cyano-6-isopropylchromone structure

CAS No:
50743-32-3
Formula:
C13H11NO2
Chemical Name:
3-Cyano-6-isopropylchromone

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3-Cyano-6-isopropylchromone Basic Attributes

Molecular Weight：

213.236

Exact Mass：

213.07900

DSSTox ID：

DTXSID10352906

Characteristics

PSA：

50.1

XLogP3：

2.6

Density：

1.2g/cm3

Melting Point：

117.0 to 121.0 °C

Boiling Point：

320.4°C at 760 mmHg

Flash Point：

139.3ºC

Refractive Index：

1.578

Safety Information

Precautionary statement(s)：

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, P501

Hazard Statements：

H302+H312+H332

GHS Classification：

|Warning|H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|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, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:213.23
XLogP3:2.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:213.078978594
Monoisotopic Mass:213.078978594
Topological Polar Surface Area:50.1
Heavy Atom Count:16
Complexity:375
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-Cyano-6-isopropylchromone

Basic Attributes
Characteristics
Safety Information
Computed Properties

3-Cyano-6-isopropylchromone

SDS

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