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hexahydrohippurate

hexahydrohippurate structure

CAS No:
32377-88-1
Formula:
C9H15NO3
Chemical Name:
hexahydrohippurate
Synonyms:
hexahydrohippurate;2-(cyclohexanecarboxamido)acetic acid;N-(Cyclohexylcarbonyl)glycin;Glycine, N-(cyclohexylcarbonyl)-;2-(cyclohexanecarbonylamino)acetic acid

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Description

Hexahydrohippurate is a N-acylglycine.

hexahydrohippurate Basic Attributes

Molecular Weight：

185.22

Exact Mass：

185.10519334 g/mol

UNII：

8QEB8PUK0Y

DSSTox ID：

DTXSID80186093

Characteristics

PSA：

66.4 Å²

Density：

1.174±0.06 g/cm3

Melting Point：

152 °C

Boiling Point：

434.6±24.0 °C(Predicted)

PKA：

3.74±0.10

Drug Information

MeSH Entry Terms：

cyclohexanoylglycine

Computed Properties

Molecular Weight:185.22
XLogP3:1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:185.10519334
Monoisotopic Mass:185.10519334
Topological Polar Surface Area:66.4
Heavy Atom Count:13
Complexity:197
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of hexahydrohippurate

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties

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