Isoamyl Phenylacetate - 97%, high purity , CAS No.102-19-2

In stock

Item Number

I117673

Grouped product items
SKU	Size	Availability	Price
I117673-25ml	25ml	≥10	$37.90
I117673-100ml	100ml	≥10	$133.90
I117673-500ml	500ml	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$600.90

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Basic Description

Synonyms	MFCD00026517 \| WLN: 1Y12OV1R \| W-108882 \| 3-Methylbutyl phenylacetate \| isoamyl phenyl acetate \| DTXSID2044501 \| phenylacetic acid 3-methylbutyl ester \| UNII-E5RHQ50DDC \| ISOAMYL PHENYL ACETATE [FCC] \| NSC60582 \| NSC-60582 \| QWBQBUWZZBUFHN-UHFFFAOYSA-N \|
Specifications & Purity	≥97%
Shipped In	Normal

Names and Identifiers

Pubchem Sid	488180501
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488180501
IUPAC Name	3-methylbutyl 2-phenylacetate
INCHI	InChI=1S/C13H18O2/c1-11(2)8-9-15-13(14)10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3
InChi Key	QWBQBUWZZBUFHN-UHFFFAOYSA-N
Canonical SMILES	CC(C)CCOC(=O)CC1=CC=CC=C1
Isomeric SMILES	CC(C)CCOC(=O)CC1=CC=CC=C1
RTECS	AJ2945000
PubChem CID	7600
Molecular Weight	206.28
Reaxy-Rn	1951778

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

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

Analytical Chart:

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4 results found

Lot Number	Certificate Type	Date	Item
H1717006	Certificate of Analysis	Mar 18, 2025	I117673
L1220051	Certificate of Analysis	Aug 19, 2024	I117673
D2315362	Certificate of Analysis	May 04, 2023	I117673
D2315363	Certificate of Analysis	Apr 23, 2023	I117673

Chemical and Physical Properties

Refractive Index	1.485～1.487
Flash Point(°F)	120℃
Flash Point(°C)	120℃
Boil Point(°C)	268°C
Molecular Weight	206.280 g/mol
XLogP3	3.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	6
Exact Mass	206.131 Da
Monoisotopic Mass	206.131 Da
Topological Polar Surface Area	26.300 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	181.000
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

RTECS

AJ2945000

Reaxy-Rn

1951778

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Basic Description