2-[[[2-[(Hydroxymethyl)[2-[(1-oxo-2-propen-1-yl)amino]ethyl]amino]ethyl]amino]carbonyl]benzoic acid
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![2-[[[2-[(Hydroxymethyl)[2-[(1-oxo-2-propen-1-yl)amino]ethyl]amino]ethyl]amino]carbonyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4a8e8b52ebe1404bb332e7fdbe2fb0ee.png "2-[[[2-[(Hydroxymethyl)[2-[(1-oxo-2-propen-1-yl)amino]ethyl]amino]ethyl]amino]carbonyl]benzoic acid")
2-[[[2-[(Hydroxymethyl)[2-[(1-oxo-2-propen-1-yl)amino]ethyl]amino]ethyl]amino]carbonyl]benzoic acid
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CAS No:
100063-60-3
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Formula:
C16H21N3O5
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Chemical Name:
2-[[[2-[(Hydroxymethyl)[2-[(1-oxo-2-propen-1-yl)amino]ethyl]amino]ethyl]amino]carbonyl]benzoic acid
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Synonyms:
Benzoic acid,2-[[[2-[(hydroxymethyl)[2-[(1-oxo-2-propen-1-yl)amino]ethyl]amino]ethyl]amino]carbonyl]-;Benzoic acid,2-[[[2-[(hydroxymethyl)[2-[(1-oxo-2-propenyl)amino]ethyl]amino]ethyl]amino]carbonyl]-;2-[[[2-[(Hydroxymethyl)[2-[(1-oxo-2-propen-1-yl)amino]ethyl]amino]ethyl]amino]carbonyl]benzoic acid;2-[[[2-[(Hydroxymethyl)[2-[(1-oxoallyl)amino]ethyl]amino]ethyl]amino]carbonyl]benzoic acid
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CAS No:
2-[[[2-[(Hydroxymethyl)[2-[(1-oxo-2-propen-1-yl)amino]ethyl]amino]ethyl]amino]carbonyl]benzoic acid Basic Attributes
335.35500
335.36
309-124-2
DTXSID60142899
Computed Properties
Molecular Weight:335.35
XLogP3:-2.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:335.14812078
Monoisotopic Mass:335.14812078
Topological Polar Surface Area:119
Heavy Atom Count:24
Complexity:455
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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