2-(Hydroxymethyl)-N-methylbenzamide

CAS 39976-03-9
C9H11NO2

2-(Hydroxymethyl)-N-methylbenzamide (CAS 39976-03-9) is a chemical compound with molecular formula C9H11NO2 and molecular weight 165.19 g/mol . GHS signal word: Warning. Hazard classifications: Health Hazard.

What is 2-(Hydroxymethyl)-N-methylbenzamide?

Molecular Formula
C9H11NO2
Molecular Weight
165.19 g/mol

Structure Identifiers

SMILES
CNC(=O)C1=CC=CC=C1CO
InChI
InChI=1S/C9H11NO2/c1-10-9(12)8-5-3-2-4-7(8)6-11/h2-5,11H,6H2,1H3,(H,10,12)
InChIKey
BFJCVRGMNCURHB-UHFFFAOYSA-N

Properties

Computed

Calculated molecular descriptors used in drug design and computational chemistry.

Exact Mass
165.0790 Da
XLogP
0.30
TPSA
49.3 Ų
H-Bond Donors
2
H-Bond Acceptors
2
Complexity
159
Formal Charge
0

Safety information

Signal Word

Warning

GHS Pictograms

GHS pictogram: Health Hazard GHS07

Hazard Statements

  • H302 Harmful if swallowed

Precautionary Statements

  • P264 Wash thoroughly after handling
  • P270 Do not eat, drink or smoke when using this product
  • P280 Wear protective gloves/protective clothing/eye protection/face protection
  • P305+P351+P338 IF IN EYES: Rinse continuously with water for several minutes. Remove contact lenses if present and easy to do, continue rinsing
  • P330 Rinse mouth
  • P501 Dispose of contents/container to an approved waste disposal plant

Synonyms (20)

  • AC6068
  • F373824
  • SB76708
  • LS-07586
  • SY022656
  • 660-615-0
  • DB-226690
  • ST5446612
  • 39976-03-9
  • CS-0187784
  • ST45022566
  • ALBB-023845
  • MFCD00157782
  • AKOS003398994
  • RefChem:461078
  • SCHEMBL6868432
  • N-methyl-2-hydroxymethylbenzamide
  • 2-(hydroxymethyl)-N-methylbenzamide
  • Benzamide, 2-(hydroxymethyl)-N-methyl-
  • [2-(hydroxymethyl)phenyl]-N-methylcarboxamide

Frequently asked questions

What is the CAS number of 2-(Hydroxymethyl)-N-methylbenzamide?

The CAS Registry Number for 2-(Hydroxymethyl)-N-methylbenzamide is 39976-03-9.

What is the molecular formula of 2-(Hydroxymethyl)-N-methylbenzamide?

2-(Hydroxymethyl)-N-methylbenzamide has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol.

What is the SMILES notation for 2-(Hydroxymethyl)-N-methylbenzamide?

The SMILES notation for 2-(Hydroxymethyl)-N-methylbenzamide is CNC(=O)C1=CC=CC=C1CO.

Is 2-(Hydroxymethyl)-N-methylbenzamide hazardous?

2-(Hydroxymethyl)-N-methylbenzamide carries the following GHS hazard classifications: Health Hazard. Signal word: Warning.

What are other names for 2-(Hydroxymethyl)-N-methylbenzamide?

2-(Hydroxymethyl)-N-methylbenzamide is also known as [2-(hydroxymethyl)phenyl]-N-methylcarboxamide, 2-(hydroxymethyl)-N-methylbenzamide, 39976-03-9, 660-615-0, AC6068.

Data sourced from PubChem CID 4147605. Last updated .

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