(S)-2-ISOCYANATO-3-PHENYLPROPIONICACIDMETHYLESTER
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(S)-2-ISOCYANATO-3-PHENYLPROPIONICACIDMETHYLESTER
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CAS No:
40203-94-9
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Formula:
C11H11NO3
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Chemical Name:
(S)-2-ISOCYANATO-3-PHENYLPROPIONICACIDMETHYLESTER
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Synonyms:
methylN-(oxomethylene)phenylalaninate;(S)-2-Isocyanato-3-phenylpropionicAcid;methyl-(s)-2-isocyanato-3-phenylpropanate;METHYL2(S)-ISOCYANATO-3-PHENYLPROPANOATE;METHYL(S)-2-ISOCYANATO-3-PHENYLPROPIONATE;METHYL(S)-(-)-2-ISOCYANATO-3-PHENYLPROPIONATE;Methyl(S)-(-)-2-isocyanato-3-phenylpropionate99%;(S)-2-ISOCYANATO-3-PHENYLPROPIONICACIDMETHYLESTER;(S)-2-ISOCYANATO-3-PHENYLPROPIONICACIDMETHYLESTER95+%
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CAS No:
Characteristics
55.73000
1.10650
1.13 g/mL at 25 °C(lit.)
23°C
244 °C(lit.)
>230 °F
n20/D 1.513(lit.)
Safety Information
UN 2206 6.1/PG 3
3
R20/21/22
S26-S36
Xn
P261-P280-P305 + P351 + P338
H226-H302-H312-H315-H319-H332-H335
|Warning|H226 (97.44%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:205.21
XLogP3:3.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:205.07389321
Monoisotopic Mass:205.07389321
Topological Polar Surface Area:55.7
Heavy Atom Count:15
Complexity:253
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
(S)-2-ISOCYANATO-3-PHENYLPROPIONICACIDMETHYLESTER
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