Bromobutide, min.98% (HPLC)

Name: Bromobutide
Brand: Chempure

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CAS Number

74712-19-9

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IUPAC name	2-bromo-3,3-dimethyl-N-(2-phenylpropan-2-yl)butanamide
inchi	InChI=1S/C15H22BrNO/c1-14(2,3)12(16)13(18)17-15(4,5)11-9-7-6-8-10-11/h6-10,12H,1-5H3,(H,17,18)
inchi key	WZDDLAZXUYIVMU-UHFFFAOYSA-N
molecular formula	C15H22BrNO
synonyms	BROMOBUTIDE 74712-19-9 Sumiherb S 47 (pesticide) 2-bromo-3,3-dimethyl-N-(2-phenylpropan-2-yl)butanamide
Compound Description	Bromobutide is a monocarboxylic acid amide having a 2-phenylpropan-2-yl substituent attached to the amide nitrogen and a 1-bromo-2,2-dimethylpropyl group attached to the carbonyl carbon. It has a role as a herbicide. It is a monocarboxylic acid amide and an organobromine compound.

Computed Properties

Molecular Weight:	312.24 g/mol
XLogP3:	3.5
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	1
Rotatable Bond Count:	4
Exact Mass:	311.08848 Da
Monoisotopic Mass:	311.08848 Da
Topological Polar Surface Area:	29.1 Å²
Heavy Atom Count:	18
Formal Charge:	0
Complexity:	287
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

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Product No: DT7983

Bromobutide, min.98% (HPLC)

Product No: DT7983

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