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4-(Diethylamino)benzaldehyde

4-(Diethylamino)benzaldehyde structure

CAS No:
120-21-8
Formula:
C11H15NO
Chemical Name:
4-(Diethylamino)benzaldehyde
Synonyms:
Benzaldehyde,4-(diethylamino)-;Benzaldehyde,p-(diethylamino)-;4-(Diethylamino)benzaldehyde;p-(Diethylamino)benzaldehyde;p-Formyl-N,N-diethylaniline;4-(N,N-Diethylamino)benzaldehyde;4-Formyl-N,N-diethylaniline;p-(N,N-Diethylamino)benzaldehyde;NSC 8782;N,N-Diethyl-4-formylaniline;4-(N,N-Diethylamine)benzaldehyde;4-(N,N-Diethylphenyl)aldehyde;N,N-Diethylaminobenzaldehyde
Categories:
Flavors and Fragrances > Synthetic Fragrances

Description

dark brown to green coarse crystals orChEBI: A member of the class of benzaldehydes carrying a diethylamino substituent at position 4.

4-(diethylamino)benzaldehyde is a member of the class of benzaldehydes carrying a diethylamino substituent at position 4. It has a role as an EC 1.2.1.3 [aldehyde dehydrogenase (NAD(+))] inhibitor. It is a member of benzaldehydes, a tertiary amino compound and an aromatic amine.

4-(Diethylamino)benzaldehyde Basic Attributes

Molecular Weight：

177.24

Exact Mass：

177.24

EC Number：

204-377-4

UNII：

S640XWL10H

NSC Number：

8782

DSSTox ID：

DTXSID0021963

HScode：

29223990

Characteristics

PSA：

20.31000

XLogP3：

2.87

Appearance：

Brown-black crystals.

Density：

1.03 g/cm3

Melting Point：

41 °C

Boiling Point：

174 °C7 mm Hg(lit.)

Flash Point：

>230 °F

Refractive Index：

1.5302 (estimate)

Water Solubility：

H2O: 2.5g/l

Storage Conditions：

Store in a cool, dry place. Store in a tightly closed container.

Vapor Pressure：

0.000176mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R21/22;R50/53

safety instructions：

26-36-61-60-36/37

RTECS Number：

CU5612850

Marks：

Xi,N,Xn

Stability/Shelf Life：

Stable under normal temperatures and pressures.

Precautionary statement(s)：

P280-P305 + P351 + P338

Hazard Statements：

H312-H315-H319-H335

GHS Classification：

|Danger|H311 (93.75%): Toxic in contact with skin [Danger Acute toxicity, dermal]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P322, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 48 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

4-(diethylamino)benzaldehyde

4-(Diethylamino)benzaldehyde Use and Manufacturing

Manufacturing Info：

Benzaldehyde, 4-(diethylamino)-: ACTIVE

Computed Properties

Molecular Weight:177.24
XLogP3:2.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:177.115364102
Monoisotopic Mass:177.115364102
Topological Polar Surface Area:20.3
Heavy Atom Count:13
Complexity:146
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(Diethylamino)benzaldehyde

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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4-(Diethylamino)benzaldehyde

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