57074-21-2 | 3-Chloro-2,6-dihydroxy-4-methylbenzaldehyde

Packsize	Purity	Availability	Price	Discounted Price
100mg	95%	2 weeks	$232.00	$162.00
250mg	95%	2 weeks	$304.00	$213.00
1g	95%	2 weeks	$839.00	$587.00

Description

• Catalog Number: AB50963
• Chemical Name: 3-Chloro-2,6-dihydroxy-4-methylbenzaldehyde
• CAS Number: 57074-21-2
• Molecular Formula: C8H7ClO3
• Molecular Weight: 186.5924
• MDL Number: MFCD06797952
• SMILES: O=Cc1c(O)cc(c(c1O)Cl)C

Computed Properties

• Complexity: 174
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 1
• XLogP3: 2.2

Literature

• SENS-IS, a 3D reconstituted epidermis based model for quantifying chemical sensitization potency: Reproducibility and predictivity results from an inter-laboratory study.

  Toxicology in vitro : an international journal published in association with BIBRA 20160401

• Is a low content in atranol/chloroatranol safe in oak moss-sensitized individuals?

  Contact dermatitis 20090201

• Selected important fragrance sensitizers in perfumes--current exposures.

  Contact dermatitis 20070401

• Mechanistic applicability domains for non-animal based prediction of toxicological endpoints. QSAR analysis of the schiff base applicability domain for skin sensitization.

  Chemical research in toxicology 20060901

• Comparison of elicitation potential of chloroatranol and atranol--2 allergens in oak moss absolute.

  Contact dermatitis 20060401

• Antimicrobial activity of extracts of chemical races of the lichen Pseudevernia furfuracea and their physodic acid, chloroatranorin, atranorin, and olivetoric acid constituents.

  Zeitschrift fur Naturforschung. C, Journal of biosciences 20060101

• Chloroatranol, an extremely potent allergen hidden in perfumes: a dose-response elicitation study.

  Contact dermatitis 20031001