4-[2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]ethyl]phenol
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![4-[2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]ethyl]phenol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4f877fe89ce740cab57564535b672c65.png "4-[2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]ethyl]phenol")
4-[2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]ethyl]phenol
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CAS No:
34315-37-2
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Formula:
C16H16BrNO3
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Chemical Name:
4-[2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]ethyl]phenol
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Synonyms:
NSC154572;MLS003106405;34315-37-2;NSC-154572;4-(2-(((6-bromo-1,3-benzodioxol-5-yl)methyl)amino)ethyl)phenol;NCIStruc1_001795;NCIStruc2_000991;CHEMBL1330957;DTXSID40302838;CCG-37080;NCGC00014419;NCI154572;ZINC31719558;AKOS010486995;NCGC00014419-02;NCGC00097524-01;NCI60_001093;SMR001821311
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CAS No:
4-[2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]ethyl]phenol Basic Attributes
350.21 g/mol
349.03136 g/mol
154572
DTXSID40302838
Computed Properties
Molecular Weight:350.21
XLogP3:3.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:349.03136
Monoisotopic Mass:349.03136
Topological Polar Surface Area:50.7
Heavy Atom Count:21
Complexity:323
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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