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2-Butoxyethyl(+)-2-(4-chloro-2-methylphenoxy)propionate

CAS
97659-39-7
Catalog Number
ACM97659397
Category
Other Products
Molecular Weight
314.804420 [g/mol]
Molecular Formula
C16H23ClO4

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Specification

Synonyms
CID90909, EINECS 245-609-4, EINECS 307-442-6, EINECS 307-443-1, 2-Butoxyethyl 2-(4-chloro-2-methylphenoxy)propionate, 2-Butoxyethyl (+)-2-(4-chloro-2-methylphenoxy)propionate, 2-Butoxyethyl (-)-2-(4-chloro-2-methylphenoxy)propionate, 23359-62-8, 97659-38-6, 97659-39-7
IUPAC Name
2-butoxyethyl 2-(4-chloro-2-methylphenoxy)propanoate
Canonical SMILES
CCCCOCCOC(=O)C(C)OC1=C(C=C(C=C1)Cl)C
InChI Key
GWFGUAFFJVHZKY-UHFFFAOYSA-N
EC Number
307-442-6
H-Bond Acceptor
4
H-Bond Donor
0
What is the PubChem CID of the compound?

The PubChem CID of the compound is 90909.

What is the molecular formula of the compound?

The molecular formula of the compound is C16H23ClO4.

What are the synonyms of the compound?

The synonyms of the compound are 23359-62-8, 2-butoxyethyl 2-(4-chloro-2-methylphenoxy)propanoate, 2-Butoxyethyl 2-(4-chloro-2-methylphenoxy)propionate, and more.

What is the molecular weight of the compound?

The molecular weight of the compound is 314.80 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 2-butoxyethyl 2-(4-chloro-2-methylphenoxy)propanoate.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C16H23ClO4/c1-4-5-8-19-9-10-20-16(18)13(3)21-15-7-6-14(17)11-12(15)2/h6-7,11,13H,4-5,8-10H2,1-3H3.

What is the InChIKey of the compound?

The InChIKey of the compound is GWFGUAFFJVHZKY-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is CCCCOCCOC(=O)C(C)OC1=C(C=C(C=C1)Cl)C.

What is the CAS number of the compound?

The CAS number of the compound is 23359-62-8.

What is the XLogP3 value of the compound?

The XLogP3 value of the compound is 4.6.

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