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2-[3-(hydroxymethyl)oxetan-3-yl]acetonitrile

2-[3-(hydroxymethyl)oxetan-3-yl]acetonitrile structure

CAS No:
42941-62-8
Formula:
C6H9NO2
Chemical Name:
2-[3-(hydroxymethyl)oxetan-3-yl]acetonitrile
Synonyms:
HT763; [3-(hydroxymethyl)oxetan-3-yl]acetonitrile; 2-(3-(hydroxymethyl)oxetan-3-yl)acetonitrile; 2-(2,3-DIMETHOXYPHENYL)BENZOIC ACID;

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2-[3-(hydroxymethyl)oxetan-3-yl]acetonitrile Basic Attributes

Molecular Weight：

127.14100

Exact Mass：

127.063328530

DSSTox ID：

DTXSID30451566

HScode：

2932999099

Characteristics

PSA：

53.25000

XLogP3：

-0.09102

Density：

1.156 g/cm3

Boiling Point：

291.5ºC at 760 mmHg

Flash Point：

130.1ºC

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:127.14
XLogP3:-1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:127.063328530
Monoisotopic Mass:127.063328530
Topological Polar Surface Area:53.2
Heavy Atom Count:9
Complexity:142
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[3-(hydroxymethyl)oxetan-3-yl]acetonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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