N-Allylaniline

• CAS: 589-09-3
• Catalog Number: ACM589093
• Category: Alkenes
• Molecular Weight: 133.19
• Molecular Formula: C₉H₁₁N
• Synonyms: ALLYLANILINE;LABOTEST-BB LTBB000531;TIMTEC-BB SBB004211;Benzenamine, N-2-propenyl-;N-Allyl-N-phenylamine;N-ALLYLANILINE;N-(2-propenyl)aniline;Allylphenylamine
• Boiling Point: 218-220°C(lit.)
• Flash Point: 193°F
• Density: 0.982g/mL at 25°C(lit.)
• Hazard Statements: Xn
• RIDADR: UN 1992 6.1(3) / PGIII
• Safety Description: 26-36/37/39-45
• Supplemental Hazard Statements: H227-H302+H312+H332-H341-H402-H301-H311-H302-H312-H315-H319-H332-H335
• Symbol: GHS07,GHS08,GHS06

Custom Q&A

What is the molecular formula of N-Allylaniline according to the reference?

The molecular formula of N-Allylaniline is C9H11N.

What is the molecular weight of N-Allylaniline?

The molecular weight of N-Allylaniline is 133.19 g/mol.

What is the IUPAC name of N-Allylaniline?

The IUPAC name of N-Allylaniline is N-prop-2-enylaniline.

What is the InChI code for N-Allylaniline?

The InChI code for N-Allylaniline is InChI=1S/C9H11N/c1-2-8-10-9-6-4-3-5-7-9/h2-7,10H,1,8H2.

What is the InChIKey for N-Allylaniline?

The InChIKey for N-Allylaniline is LQFLWKPCQITJIH-UHFFFAOYSA-N.

What is the canonical SMILES representation of N-Allylaniline?

The canonical SMILES representation of N-Allylaniline is C=CCNC1=CC=CC=C1.

What is the CAS number for N-Allylaniline?

The CAS number for N-Allylaniline is 589-09-3.

What is the XLogP3-AA value for N-Allylaniline?

The XLogP3-AA value for N-Allylaniline is 2.5.

How many hydrogen bond donor counts does N-Allylaniline have?

N-Allylaniline has 1 hydrogen bond donor count.

How many rotatable bond counts does N-Allylaniline have?

N-Allylaniline has 3 rotatable bond counts.