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Structure

N'-Hydroxy-3-methylbenzenecarboximidamide

CAS
40067-82-1
Catalog Number
ACM40067821
Category
Other Products
Molecular Weight
150.18
Molecular Formula
C8H10N2O

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Specification

Synonyms
3-Methylbenzamide oxime, 40067-82-1, AC1LBZB8, Maybridge3_007466, ACMC-20ak40, CTK4I2373, CTK8A6699, N-HYDROXY-3-METHYL-BENZAMIDINE, AG-B-37077, AG-C-13440, KB-58303, Benzenecarboximidamide,N-hydroxy-3-methyl-, 3-methyl-N-oxidanyl-benzenecarboximidamide, A824883
IUPAC Name
N-hydroxy-3-methylbenzenecarboximidamide
Canonical SMILES
CC1=CC=CC(=C1)C(=NO)N
InChI Key
KJMNPGUHEUTHMR-UHFFFAOYSA-N
Boiling Point
329.5ºC at 760 mmHg
Melting Point
82-87ºC(lit.)
Density
1.14 g/cm³
Exact Mass
150.07900
Hazard Statements
Xi
H-Bond Acceptor
2
H-Bond Donor
2
Safety Description
S26-S36
WGK Germany
3

Upstream Synthesis Route 1

  • 620-22-4
  • 40067-82-1

Reference: [1]ChemMedChem,2019,vol. 14,p. 1257 - 1270

Downstream Synthesis Route 1

  • 108-30-5
  • 40067-82-1
  • 94192-16-2

Reference: [1]Srivastava; Borges Viana de; Bieber
[Journal of Heterocyclic Chemistry, 1984, vol. 21, # 4, p. 1193 - 1195]
[2]Srivastava, Rajendra Mohan; Da Conceição Pereira, Maria; Hallwass, Fernando; Pacheco, Carlos R. N.
[Heterocycles, 1999, vol. 51, # 12, p. 2961 - 2967]

Downstream Synthesis Route 2

  • 40067-82-1
  • 100-52-7
  • 111249-50-4

Reference: [1]Srivastava; Freire; Chaves; et al.
[Journal of Heterocyclic Chemistry, 1987, vol. 24, # 1, p. 101 - 105]
[2]Wang, Wei; Xu, Hao; Xu, Yuanqing; Ding, Tao; Zhang, Wenkai; Ren, Yanrong; Chang, Haibo
[Organic and Biomolecular Chemistry, 2016, vol. 14, # 41, p. 9814 - 9822]

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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