2,3-Dimethyl-2-butanol

CAT: 0127-OR1044177-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1044177-01Size:100 mg

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CAS Number

594-60-5

Synonyms

2,3-dimethylbutan-2-ol

Purity

98%

Smiles

OC(C)(C)C(C)C

Chemical Information

2,3-Dimethyl-2-butanol

CAS Number	594-60-5
PubChem CID	11670
IUPAC Name	2,3-dimethylbutan-2-ol
Molecular Formula	C6H14O
Molecular Weight	102.17
XLogP	1.5
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	7
Formal Charge	0
Complexity	55

SMILES

CC(C)C(C)(C)O

InChI

InChI=1S/C6H14O/c1-5(2)6(3,4)7/h5,7H,1-4H3

InChIKey

IKECULIHBUCAKR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 594-60-5

CID: 11670

Formula: C6H14O

MW: 102.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	102.17
XLogP3	1.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	102.104465066
Monoisotopic Mass	102.104465066
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	55.2
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR72728	(R)-3,3-Dimethyl-2-butanol
OR1010756-01	3,3-Dimethyl-1-Butanol
OR1028184-01	3-Mercapto-2-Butanol
OR1021518	3-Methoxy-2-butanol
OR1010509-01	2-Mercapto-3-Butanol
OR470142	2,3,3-Trimethyl-2-butanol
OR304036-01	(S) - (-) -2-Amino-3,3-dimethyl-1,1-diphenyl-1-butanol
OR470923	3- (Boc-amino) -2-butanol
OR1008395-01	(R) - (-) -3-Methyl-2-Butanol
OR304038-01	(R) - (-) -2-Butanol

Catalog	Name
sc-230842	2,3-Dimethyl-2-butanol
TRC-D471480-10G	3,3-Dimethyl-2-butanol
D38470-01	2,3-Dimethyl-2-butanol 97%
D38460	2,2-Dimethyl-3-butanol 97%
TRC-D492532-500MG	2,3-Dimethyl-3-(methylamino)-2-butanol
426775-01	3,3-Dimethyl-2-butanol-d3
AR-B08149-01	3,3-dimethyl-2-butanol-d13
JH154646	(S) -3,3-DIMETHYL-2-BUTANOL
419309-01	2,2-Dimethyl-1-butanol
010352	2,2-Dimethyl-2-butanol-d6