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3,5-DI-TERT-BUTYL-4-HYDROXYBENZALDEHYDE HEMIHYDRATE

3,5-DI-TERT-BUTYL-4-HYDROXYBENZALDEHYDE HEMIHYDRATE structure

CAS No:
207226-32-2
Formula:
C15H24O3
Chemical Name:
3,5-DI-TERT-BUTYL-4-HYDROXYBENZALDEHYDE HEMIHYDRATE
Synonyms:
3,5-DI-TERT-BUTYL-4-HYDROXYBENZALDEHYDE HEMIHYDRATE;3,5-DI-T-BUTYL-4-HYDROXYBENZALDEHYDE HEMIHYDRATE;LABOTEST-BB LT00233130;3,5-DI-TERT-BBUTYL-4-HYDROXYBENZALDEHYDE;2,6-Bis(tert-butyl)-4-formylphenol hemihydrate;3,5-Bis(tert-butyl)-4-hydroxybenzaldehyde hemihydrate

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3,5-DI-TERT-BUTYL-4-HYDROXYBENZALDEHYDE HEMIHYDRATE Basic Attributes

Molecular Weight：

252.35

Exact Mass：

252.17300

EC Number：

216-592-0

DSSTox ID：

DTXSID00669999

Characteristics

PSA：

46.53000

XLogP3：

3.73540

Melting Point：

187-189 °C(lit.)

Water Solubility：

ethanol: soluble 50mg/mL, clear to slightly hazy (yellow to orange to light red-brown)

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36/37

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

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|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:252.35
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:252.17254462
Monoisotopic Mass:252.17254462
Topological Polar Surface Area:38.3
Heavy Atom Count:18
Complexity:246
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 3,5-DI-TERT-BUTYL-4-HYDROXYBENZALDEHYDE HEMIHYDRATE

Basic Attributes
Characteristics
Safety Information
Computed Properties
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3,5-DI-TERT-BUTYL-4-HYDROXYBENZALDEHYDE HEMIHYDRATE

SDS

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