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4-Isobutylbenzoic Acid - >99.0%(GC)(T), high purity , CAS No.38861-88-0

≥99%(GC)(T)

CAS#: 38861-88-0
Formula: C₁₁H₁₄O₂
Molecular Weight: 178.23
Beilstein Registry Number: 9(4)1882
MDL number: MFCD00191658
PubChem CID: 38111

Item Number

I157572

Grouped product items
SKU	Size	Availability	Price
I157572-1g	1g	In stock	$23.90
I157572-10g	10g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$177.90
I157572-25g	25g	In stock	$332.90

View related series

carboxylic acid Non heterocyclic block

Basic Description

Synonyms	4-Isobutylbenzoic acid \| 38861-88-0 \| 4-(2-methylpropyl)benzoic acid \| Benzoic acid, 4-(2-methylpropyl)- \| BENZOIC ACID, p-ISOBUTYL- \| p-isobutylbenzoic acid \| CHEMBL4083814 \| MFCD00191658 \| 599E5B23F1 \| NSC-168984 \| NSC 168984 \| BRN 2207397 \| 4-isobutyl benzoic acid \| 4-isobutyl-
Specifications & Purity	≥99%(GC)(T)
Shipped In	Normal

Associated Targets(Human)

ASIC3 Tchem Acid-sensing ion channel 3 (0 Activities)

Discover Target: ASIC3

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

ASIC1 Tchem Acid-sensing ion channel 1 (0 Activities)

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Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

ASIC2 Tchem Acid-sensing ion channel 2 (0 Activities)

Discover Target: ASIC2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

ASIC3 Tchem Amiloride-sensitive cation channel 3 (217 Activities)

Discover Target: ASIC3

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Asic1 Acid-sensing ion channel 1 (41 Activities)

Discover Target: Asic1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Asic2 Acid-sensing ion channel 2 (38 Activities)

Discover Target: Asic2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Names and Identifiers

IUPAC Name	4-(2-methylpropyl)benzoic acid
INCHI	InChI=1S/C11H14O2/c1-8(2)7-9-3-5-10(6-4-9)11(12)13/h3-6,8H,7H2,1-2H3,(H,12,13)
InChi Key	VUBBCFWWSKOHTH-UHFFFAOYSA-N
Canonical SMILES	CC(C)CC1=CC=C(C=C1)C(=O)O
Isomeric SMILES	CC(C)CC1=CC=C(C=C1)C(=O)O
RTECS	DH3073800
PubChem CID	38111
Molecular Weight	178.23
Beilstein	9(4)1882
Reaxy-Rn	2207397

Certificates

Certificate of Analysis(COA)

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3 results found

Lot Number	Certificate Type	Date	Item
G2229360	Certificate of Analysis	Jun 19, 2022	I157572
G2229361	Certificate of Analysis	Jun 19, 2022	I157572
G2229396	Certificate of Analysis	Jun 19, 2022	I157572

Solubility

Soluble in Methanol

Melt Point(°C)

144 °C

Safety and Hazards(GHS)

Pictogram(s)	GHS07
Signal	Warning
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation H302:Harmful if swallowed
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P270:Do not eat, drink or smoke when using this product. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P330:Rinse mouth. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P301+P317:IF SWALLOWED: Get medical help. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell.
RTECS	DH3073800
Reaxy-Rn	2207397

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