2-[(4-Methyl-2-pyrimidinyl)thio]acetic acid
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![2-[(4-Methyl-2-pyrimidinyl)thio]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/63a3e3dabd564e4985d66aa3d515765d.png "2-[(4-Methyl-2-pyrimidinyl)thio]acetic acid")
2-[(4-Methyl-2-pyrimidinyl)thio]acetic acid
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CAS No:
46118-95-0
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Formula:
C7H8N2O2S
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Chemical Name:
2-[(4-Methyl-2-pyrimidinyl)thio]acetic acid
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Synonyms:
Acetic acid,2-[(4-methyl-2-pyrimidinyl)thio]-;Acetic acid,[(4-methyl-2-pyrimidinyl)thio]-;2-[(4-Methyl-2-pyrimidinyl)thio]acetic acid;2-(Carboxymethylthio)-4-methylpyrimidine;[(4-Methyl-2-pyrimidinyl)sulfanyl]acetic acid;NSC 164942;2-[(4-Methylpyrimidin-2-yl)thio]acetic acid;[(4-Methyl-2-pyrimidinyl)thio]acetic acid;2-(4-Methylpyrimidin-2-yl)sulfanylacetic acid;2-[(4-Methylpyrimidin-2-yl)sulfanyl]acetic acid
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CAS No:
2-[(4-Methyl-2-pyrimidinyl)thio]acetic acid Basic Attributes
184.22
184.22
150424
256-253-4
164942
DTXSID00196730
2933599090
Safety Information
36/37/38
24/25
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, 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:184.22
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:184.03064868
Monoisotopic Mass:184.03064868
Topological Polar Surface Area:88.4
Heavy Atom Count:12
Complexity:166
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-[(4-Methyl-2-pyrimidinyl)thio]acetic acid
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