Allyl-but-2-ynyl-amine hydrochloride

Catalog Number
ACMA00000720
Category
Alkynyl
Molecular Weight
145.63

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Specification

Hazard Statements
H226
RIDADR
UN 3077 9 / PGIII
Symbol
GHS02
What is the molecular formula of Allyl-but-2-ynyl-amine hydrochloride?

The molecular formula is C7H12ClN.

What is the molecular weight of Allyl-but-2-ynyl-amine hydrochloride?

The molecular weight is 145.63 g/mol.

What is the IUPAC name of Allyl-but-2-ynyl-amine hydrochloride?

The IUPAC name is N-prop-2-enylbut-2-yn-1-amine; hydrochloride.

What is the InChI of Allyl-but-2-ynyl-amine hydrochloride?

The InChI is InChI=1S/C7H11N.ClH/c1-3-5-7-8-6-4-2;/h4,8H,2,6-7H2,1H3;1H.

What is the InChIKey of Allyl-but-2-ynyl-amine hydrochloride?

The InChIKey is LXJSIVRUGSJVHN-UHFFFAOYSA-N.

What is the canonical SMILES of Allyl-but-2-ynyl-amine hydrochloride?

The canonical SMILES is CC#CCNCC=C.Cl.

What is the CAS number of Allyl-but-2-ynyl-amine hydrochloride?

The CAS number is 436099-58-0.

What is the hydrogen bond donor count of Allyl-but-2-ynyl-amine hydrochloride?

The hydrogen bond donor count is 2.

What is the hydrogen bond acceptor count of Allyl-but-2-ynyl-amine hydrochloride?

The hydrogen bond acceptor count is 1.

Is Allyl-but-2-ynyl-amine hydrochloride a canonicalized compound?

Yes, it is a canonicalized compound.

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