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Anisyl Formate - ≥98%, high purity , CAS No.122-91-8

COA

Grade & Purity:

≥98%

Cas Number: 122-91-8
Molecular Weight: 166.17
PubChem CID: 61054
PubChem SID: 488183437

In stock

Item Number

A302664

Grouped product items
SKU	Size	Availability	Price
A302664-5g	5g	3	$42.90
A302664-25g	25g	4	$138.90
A302664-100g	100g	3	$378.90
A302664-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$1,374.90

Basic Description

Synonyms	4-Methoxybenzyl formate \| Anisyl formate \| 122-91-8 \| (4-methoxyphenyl)methyl formate \| p-Methoxybenzyl formate \| Anisyl alcohol, formate \| Anisyl methanoate \| Benzenemethanol, 4-methoxy-, 1-formate \| p-Methoxybenzyl alcohol, formate \| BENZENEMETHANOL, 4-METHOXY-, FORMATE \|
Specifications & Purity	≥98%
Storage Temp	Room temperature,Desiccated
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzyloxycarbonyls

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzyloxycarbonyls
Intermediate Tree Nodes	Not available
Direct Parent	Benzyloxycarbonyls
Alternative Parents	Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzyloxycarbonyl - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organic oxygen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzyloxycarbonyls. These are organic compounds containing a carbonyl group substituted with a benzyloxyl group.
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

Pubchem Sid	488183437
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488183437
IUPAC Name	(4-methoxyphenyl)methyl formate
INCHI	InChI=1S/C9H10O3/c1-11-9-4-2-8(3-5-9)6-12-7-10/h2-5,7H,6H2,1H3
InChIKey	XPDORSROGAZEGY-UHFFFAOYSA-N
Smiles	COC1=CC=C(C=C1)COC=O
Isomeric SMILES	COC1=CC=C(C=C1)COC=O
Molecular Weight	166.17
Reaxy-Rn	3249445
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3249445&ln=

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

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

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
K2209245	Certificate of Analysis	Oct 25, 2022	A302664
K2209239	Certificate of Analysis	Oct 25, 2022	A302664
K2209240	Certificate of Analysis	Oct 25, 2022	A302664
L2416252	Certificate of Analysis	Oct 25, 2022	A302664
E2324161	Certificate of Analysis	Oct 25, 2022	A302664
K2209236	Certificate of Analysis	Oct 25, 2022	A302664

Chemical and Physical Properties

Flash Point(°C)	>113 °C
Boil Point(°C)	220 °C
Molecular Weight	166.170 g/mol
XLogP3	1.700
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	166.063 Da
Monoisotopic Mass	166.063 Da
Topological Polar Surface Area	35.500 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	128.000
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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