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(Diethoxymethyl)benzene

(Diethoxymethyl)benzene structure

CAS No:
774-48-1
Formula:
C11H16O2
Chemical Name:
(Diethoxymethyl)benzene
Synonyms:
Benzene,(diethoxymethyl)-;Benzaldehyde,diethyl acetal;(Diethoxymethyl)benzene;α,α-Diethoxytoluene;Diethoxyphenylmethane;Diethyl benzaldehyde acetal;Ethyl phenyl acetal;NSC 287;1,1-Diethoxymethylbenzene
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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(Diethoxymethyl)benzene Basic Attributes

Molecular Weight：

180.24

Exact Mass：

180.24

EC Number：

212-265-1

UNII：

236M0R125W

NSC Number：

287

DSSTox ID：

DTXSID4061127

HScode：

2909309090

Characteristics

PSA：

18.5

XLogP3：

2.75820

Density：

0.97875 g/cm³ @ Temp: 25 °C

Melting Point：

260-262 °C

Boiling Point：

105-115 °C

Flash Point：

64.5ºC

Refractive Index：

1.486

Safety Information

hazard class code：

36/37/38

safety instructions：

26-36/37/39

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 1376 companies from 2 notifications to the ECHA C&L Inventory.

(Diethoxymethyl)benzene Use and Manufacturing

Manufacturing Info：

Benzene, (diethoxymethyl)-: ACTIVE

Use Classification：

Food additives -> Flavoring Agents

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:180.24
XLogP3:2.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:180.115029749
Monoisotopic Mass:180.115029749
Topological Polar Surface Area:18.5
Heavy Atom Count:13
Complexity:113
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 774-48-1

Grade: Industrial Grade

Content: 99%

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