alpha-Ethenylbenzylamine - CAS 4393-21-9

Catalog:	BB025500
Product Name:	alpha-Ethenylbenzylamine
CAS:	4393-21-9
Synonyms:	1-phenyl-2-propen-1-amine; 1-phenylprop-2-en-1-amine

Technical Data

Patents

Computed Properties

IUPAC Name:	1-phenylprop-2-en-1-amine
Description:	alpha-Ethenylbenzylamine (CAS# 4393-21-9 ) is a useful research chemical.
Molecular Weight:	133.19
Molecular Formula:	C9H11N
Canonical SMILES:	C=CC(C1=CC=CC=C1)N
InChI:	InChI=1S/C9H11N/c1-2-9(10)8-6-4-3-5-7-8/h2-7,9H,1,10H2
InChI Key:	VESLRNDUOCLYDT-UHFFFAOYSA-N
LogP:	2.57270

Publication Number	Title	Priority Date
AU-2021102831-A4	Method for Detecting Quorum Sensing Molecules in Microbial Aggregates by UPLC-MS/MS	20210525
CN-112986420-A	Method for detecting microbial aggregate quorum sensing effect molecules by UPLC-MS/MS method	20210208
JP-2021066746-A	Conjugates of cytotoxic agents and cell-binding receptors	20210204
AU-2021100248-A4	Method for Screening gRNA Target Sequence Containing PAM Structure Based on Character Slicing Technology and Application Thereof	20210115
JP-2021073185-A	Its use in novel conjugates and specific conjugation of biomolecules with drugs	20201224

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Complexity:	103
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	133.089149355
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	133.089149355
Rotatable Bond Count:	2
Topological Polar Surface Area:	26
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6