4-Methoxycinnamonitrile
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4-Methoxycinnamonitrile
structure -
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CAS No:
28446-68-6
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Formula:
C10H9NO
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Chemical Name:
4-Methoxycinnamonitrile
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Synonyms:
2-Propenenitrile,3-(4-methoxyphenyl)-;Cinnamonitrile,p-methoxy-;3-(4-Methoxyphenyl)-2-propenenitrile;4-Methoxycinnamonitrile;3-(p-Anisyl)acrylonitrile;p-Methoxycinnamonitrile;β-(4-Methoxyphenyl)acrylonitrile;NSC 379284;3-(4-Methoxyphenyl)acrylonitrile
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CAS No:
Characteristics
33.02000
2.23198
1.096 g/mL at 25 °C(lit.)
61-62 °C
127-140 °C1 mm Hg(lit.)
>230 °F
n20/D 1.6131(lit.)
Safety Information
III
6.1
3276
3
20/21/22
36
GE1459320
Xn
P280
H302 + H312 + H332
|Warning|H302 (97.67%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:159.18
XLogP3:2.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:159.068413911
Monoisotopic Mass:159.068413911
Topological Polar Surface Area:33
Heavy Atom Count:12
Complexity:193
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes