3,3-Dimethyl-1-butanol - ≥96%, high purity , CAS No.624-95-3

Name: 3,3-Dimethyl-1-butanol - ≥96%, high purity , CAS No.624-95-3
Price: 9.9 USD
Availability: InStock

Grade & Purity:

In stock

Item Number

D139098

Grouped product items
SKU	Size	Availability	Price
D139098-1g	1g	10	$9.90
D139098-5g	5g	4	$26.90
D139098-10g	10g	4	$47.90
D139098-25g	25g	5	$86.90
D139098-50g	50g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$155.90
D139098-100g	100g	9	$280.90
D139098-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$1,260.90

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Synonyms	Q25109997 \| EN300-95055 \| BBL103889 \| DIMBUNOL \| AS-18452 \| tert-Hexanol \| J-511080 \| 3,3-dimethyl butan-1-ol \| 3,3-Dimethyl-1-butanol; 3,3-Dimethylbutanol; Dimbunol; NSC 54158; 1-Butanol, 3,3-dimethyl- \| 1-Butanol, 3,3-dimethyl \| 1-Butanol, 3,3-dimethyl-
Specifications & Purity	≥96%
Shipped In	Normal
Product Description	3,3-Dimethyl-1-butanol is a glass forming material. The molecular dynamics of 3,3-dimethyl-1-butanol was studied.

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Alcohols and polyols
Intermediate Tree Nodes	Not available
Direct Parent	Primary alcohols
Alternative Parents	Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Hydrocarbon derivative - Primary alcohol - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as primary alcohols. These are compounds comprising the primary alcohol functional group, with the general structure RCOH (R=alkyl, aryl).
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

Pubchem Sid	488181589
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488181589
IUPAC Name	3,3-dimethylbutan-1-ol
INCHI	InChI=1S/C6H14O/c1-6(2,3)4-5-7/h7H,4-5H2,1-3H3
InChIKey	DUXCSEISVMREAX-UHFFFAOYSA-N
Smiles	CC(C)(C)CCO
Isomeric SMILES	CC(C)(C)CCO
WGK Germany	3
UN Number	1987
Packing Group	III
Molecular Weight	102.17
Beilstein	1731466
Reaxy-Rn	1731466
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1731466&ln=

Lot Number	Certificate Type	Date	Item
E2324264	Certificate of Analysis	Mar 04, 2025	D139098
D23061071	Certificate of Analysis	Jan 20, 2025	D139098
D23061070	Certificate of Analysis	Jan 20, 2025	D139098
B2306882	Certificate of Analysis	Nov 14, 2024	D139098
K2207068	Certificate of Analysis	Aug 22, 2024	D139098
F2225173	Certificate of Analysis	Apr 03, 2024	D139098
F2225180	Certificate of Analysis	Apr 03, 2024	D139098
F2225169	Certificate of Analysis	Apr 03, 2024	D139098
F2225175	Certificate of Analysis	Apr 03, 2024	D139098
F2225350	Certificate of Analysis	Apr 03, 2024	D139098
H2104150	Certificate of Analysis	May 12, 2023	D139098
H2104152	Certificate of Analysis	May 12, 2023	D139098
H2104153	Certificate of Analysis	May 12, 2023	D139098
H2104151	Certificate of Analysis	May 12, 2023	D139098
H2104149	Certificate of Analysis	May 10, 2023	D139098
G2109067	Certificate of Analysis	Apr 17, 2023	D139098
B2306883	Certificate of Analysis	Feb 16, 2023	D139098
G1901021	Certificate of Analysis	Feb 08, 2023	D139098

Solubility	Slightly soluble in water.
Refractive Index	1.414
Flash Point(°F)	133 °F
Flash Point(°C)	56°C
Boil Point(°C)	142-143℃
Melt Point(°C)	-60℃
Molecular Weight	102.170 g/mol
XLogP3	1.600
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	102.104 Da
Monoisotopic Mass	102.104 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	42.600
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

Basic Description