3-Chloro-4-methoxybenzylamine hydrochloride

• CAS: 41965-95-1
• Catalog Number: ACM41965951
• Category: Amine Salts
• Molecular Weight: 208.09
• Molecular Formula: C₇H₁₆ClN
• Synonyms: ZINC00170050, CID4452851, 41965-95-1
• IUPAC Name: (3-chloro-4-methoxyphenyl)methylazanium
• SMILES: COC1=C(C=C(C=C1)CN)Cl.Cl
• InChI Key: OCNMSDZALRAYEX-UHFFFAOYSA-O
• Boiling Point: 263.5ºC at 760 mmHg
• Melting Point: 250-255ºC(lit.)
• Flash Point: 113.2ºC
• Appearance: WHITE TO YELLOW POWDER, CRYSTALS OR CRYSTALLINE POWDER AND/OR CHUNKS
• EC Number: 609-972-6
• Exact Mass: 207.02200
• Hazard Statements: H302-H317-H319
• H-Bond Acceptor: 1
• H-Bond Donor: 1
• RIDADR: NONH for all modes of transport
• Safety Description: 26-36/37-45
• Symbol: GHS07
• WGK Germany: 3

Custom Q&A

What is the molecular formula of 3-Chloro-4-methoxybenzylamine hydrochloride?

The molecular formula is C8H11Cl2NO.

What is the molecular weight of 3-Chloro-4-methoxybenzylamine hydrochloride?

The molecular weight is 208.08 g/mol.

What is the IUPAC name of 3-Chloro-4-methoxybenzylamine hydrochloride?

The IUPAC name is (3-chloro-4-methoxyphenyl)methanamine hydrochloride.

What is the InChI of 3-Chloro-4-methoxybenzylamine hydrochloride?

The InChI is InChI=1S/C8H10ClNO.ClH/c1-11-8-3-2-6(5-10)4-7(8)9;/h2-4H,5,10H2,1H3;1H.

What is the InChIKey of 3-Chloro-4-methoxybenzylamine hydrochloride?

The InChIKey is IKWWOZCEHOYKAO-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Chloro-4-methoxybenzylamine hydrochloride?

The canonical SMILES is COC1=C(C=C(C=C1)CN)Cl.Cl.

What is the CAS number of 3-Chloro-4-methoxybenzylamine hydrochloride?

The CAS number is 41965-95-1.

What is the European Community (EC) number of 3-Chloro-4-methoxybenzylamine hydrochloride?

The EC number is 609-972-6.

What is the hydrogen bond donor count of 3-Chloro-4-methoxybenzylamine hydrochloride?

The hydrogen bond donor count is 2.

What is the hydrogen bond acceptor count of 3-Chloro-4-methoxybenzylamine hydrochloride?

The hydrogen bond acceptor count is 2.