4-[(1-Pyrrolidinylsulfonyl)methyl]benzenamine
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![4-[(1-Pyrrolidinylsulfonyl)methyl]benzenamine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/1c6f06dfa1e4429986b4723885cd7c12.png "4-[(1-Pyrrolidinylsulfonyl)methyl]benzenamine")
4-[(1-Pyrrolidinylsulfonyl)methyl]benzenamine
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CAS No:
334981-10-1
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Formula:
C11H16N2O2S
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Chemical Name:
4-[(1-Pyrrolidinylsulfonyl)methyl]benzenamine
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Synonyms:
Benzenamine,4-[(1-pyrrolidinylsulfonyl)methyl]-;Pyrrolidine,1-[[(4-aminophenyl)methyl]sulfonyl]-;4-[(1-Pyrrolidinylsulfonyl)methyl]benzenamine;1-((4-Aminobenzenemethane)sulfonyl)pyrrolidine
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CAS No:
4-[(1-Pyrrolidinylsulfonyl)methyl]benzenamine Basic Attributes
240.32194
240.32
1308068-626-2
DTXSID80458020
2935009090
Characteristics
71.8
0.76
Pale yellow solid
1.3±0.1 g/cm3
170-176°C
434.2±47.0 °C at 760 mmHg
216.4±29.3 °C
1.618
Refrigerator
Safety Information
P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
4-[(1-Pyrrolidinylsulfonyl)methyl]benzenamine Use and Manufacturing
Intermediate in the preparation of Almotriptan.
Computed Properties
Molecular Weight:240.32
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:240.09324893
Monoisotopic Mass:240.09324893
Topological Polar Surface Area:71.8
Heavy Atom Count:16
Complexity:309
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-[(1-Pyrrolidinylsulfonyl)methyl]benzenamine
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