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DIETHYL3,4-PROPYLENEDIOXYPYRROLE-2,5-D&

DIETHYL3,4-PROPYLENEDIOXYPYRROLE-2,5-D& structure

CAS No:
870704-20-4
Formula:
C13H17NO6
Chemical Name:
DIETHYL3,4-PROPYLENEDIOXYPYRROLE-2,5-D&
Synonyms:
2H,7H-[1,4]Dioxepino[2,3-c]pyrrole-6,8-dicarboxylic acid, 3,4-dihydro-, 6,8-diethyl ester

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DIETHYL3,4-PROPYLENEDIOXYPYRROLE-2,5-D& Basic Attributes

Molecular Weight：

283.28

Exact Mass：

283.10558726

DSSTox ID：

DTXSID30584525

Characteristics

Density：

1.269±0.06 g/cm3

Melting Point：

74.0-75.5 °C(lit.)

Boiling Point：

457.5±45.0 °C(Predicted)

PKA：

12.63±0.20

Safety Information

hazard class code：

safety instructions：

Marks：

GHS Classification：

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:283.28
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:283.10558726
Monoisotopic Mass:283.10558726
Topological Polar Surface Area:86.8
Heavy Atom Count:20
Complexity:329
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of DIETHYL3,4-PROPYLENEDIOXYPYRROLE-2,5-D&

Basic Attributes
Characteristics
Safety Information
Computed Properties

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