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tert-butyl N-(3,5-dichloro-4-hydroxy-phenyl)carbamate - 97%, high purity , CAS No.155891-93-3

COA

Grade & Purity:

≥97%

Cas Number: 155891-93-3
Molecular Weight: 278.13
PubChem CID: 22048528

In stock

Item Number

T629701

Grouped product items
SKU	Size	Availability	Price
T629701-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$147.90
T629701-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$245.90
T629701-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$346.90
T629701-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$494.90
T629701-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,476.90

Basic Description

Synonyms	155891-93-3 \| (3,5-Dichloro-4-hydroxy-phenyl)-carbamic Acid Tert-butyl Ester \| tert-butyl N-(3,5-dichloro-4-hydroxyphenyl)carbamate \| tert-Butyl (3,5-dichloro-4-hydroxyphenyl)carbamate \| (3,5-Dichloro-4-hydroxy-phenyl)-carbamicacidtert-butylester \| tert-b
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Phenylcarbamic acid esters

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Phenylcarbamic acid esters
Intermediate Tree Nodes	Not available
Direct Parent	Phenylcarbamic acid esters
Alternative Parents	O-chlorophenols Dichlorobenzenes Aryl chlorides Carbamate esters Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenylcarbamic acid ester - 1,3-dichlorobenzene - 2-halophenol - 2-chlorophenol - Chlorobenzene - Phenol - Halobenzene - Aryl chloride - Aryl halide - Carbamic acid ester - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylcarbamic acid esters. These are ester derivatives of phenylcarbamic acids.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	tert-butyl N-(3,5-dichloro-4-hydroxyphenyl)carbamate
INCHI	InChI=1S/C11H13Cl2NO3/c1-11(2,3)17-10(16)14-6-4-7(12)9(15)8(13)5-6/h4-5,15H,1-3H3,(H,14,16)
InChIKey	GUEFWIPNCZYUAR-UHFFFAOYSA-N
Smiles	CC(C)(C)OC(=O)NC1=CC(=C(C(=C1)Cl)O)Cl
Isomeric SMILES	CC(C)(C)OC(=O)NC1=CC(=C(C(=C1)Cl)O)Cl
PubChem CID	22048528
Molecular Weight	278.13

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	278.130 g/mol
XLogP3	3.400
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	277.027 Da
Monoisotopic Mass	277.027 Da
Topological Polar Surface Area	58.600 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	268.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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