N-Allylbenzylamine - CAS 4383-22-6

Catalog:	BB025476
Product Name:	N-Allylbenzylamine
CAS:	4383-22-6
Synonyms:	N-(phenylmethyl)-2-propen-1-amine; N-benzylprop-2-en-1-amine

Technical Data

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Computed Properties

IUPAC Name:	N-benzylprop-2-en-1-amine
Description:	N-Allylbenzylamine (CAS# 4383-22-6) is a useful research chemical.
Molecular Weight:	147.22
Molecular Formula:	C10H13N
Canonical SMILES:	C=CCNCC1=CC=CC=C1
InChI:	InChI=1S/C10H13N/c1-2-8-11-9-10-6-4-3-5-7-10/h2-7,11H,1,8-9H2
InChI Key:	RHUCQDQRNUUMKY-UHFFFAOYSA-N
Boiling Point:	217.7 °C at 760 mmHg
Density:	0.924 g/cm³
MDL:	MFCD00463446
LogP:	2.35310

Publication Number	Title	Priority Date
WO-2021187407-A1	Composition for power storage device, slurry for power storage device electrode, power storage device electrode, and power storage device	20200319
US-2021284778-A1	Photochromic polydiorganosiloxane vinylic crosslinkers	20200311
US-2021284806-A1	Photochromic polydiorganosiloxane vinylic crosslinkers	20200311
WO-2021181307-A1	Photochromic polydiorganosiloxane vinylic crosslinkers	20200311
WO-2021181341-A1	Photochromic polydiorganosiloxane vinylic crosslinkers	20200311

PMID	Publication Date	Title	Journal
16076166	20050810	Domino coupling relay approach to polycyclic pyrrole-2-carboxylates	Journal of the American Chemical Society

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GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	103
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	147.104799419
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	147.104799419
Rotatable Bond Count:	4
Topological Polar Surface Area:	12 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2