4-[4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy]butanoic acid
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![4-[4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/2681c5aad32d4a34a47dd356085706a3.png "4-[4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy]butanoic acid")
4-[4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy]butanoic acid
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CAS No:
355017-64-0
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Formula:
C12H15NO7
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Chemical Name:
4-[4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy]butanoic acid
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CAS No:
4-[4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy]butanoic acid Basic Attributes
285.25000
285.08485182
DTXSID10401463
2918990090
Safety Information
S22; S24/25
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, 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:285.25
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:285.08485182
Monoisotopic Mass:285.08485182
Topological Polar Surface Area:122
Heavy Atom Count:20
Complexity:330
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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