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5-(1,3-DIHYDRO-ISOINDOL-2-YL)-PENTANOICACID

5-(1,3-DIHYDRO-ISOINDOL-2-YL)-PENTANOICACID structure

CAS No:
312606-96-5
Formula:
C13H17NO2
Chemical Name:
5-(1,3-DIHYDRO-ISOINDOL-2-YL)-PENTANOICACID
Synonyms:
5-(1,3-DIHYDRO-ISOINDOL-2-YL)-PENTANOIC ACID;2H-Isoindole-2-pentanoic acid, 1,3-dihydro-

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5-(1,3-DIHYDRO-ISOINDOL-2-YL)-PENTANOICACID Basic Attributes

Molecular Weight：

219.28

Exact Mass：

219.125928785 g/mol

DSSTox ID：

DTXSID10366366

Characteristics

PSA：

40.5 Å²

Density：

1.146±0.06 g/cm3

Boiling Point：

368.8±30.0 °C(Predicted)

PKA：

4.61±0.10

Safety Information

Hazard category：

IRRITANT

Marks：

Computed Properties

Molecular Weight:219.28
XLogP3:-0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:219.125928785
Monoisotopic Mass:219.125928785
Topological Polar Surface Area:40.5
Heavy Atom Count:16
Complexity:228
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(1,3-DIHYDRO-ISOINDOL-2-YL)-PENTANOICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

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