2-Dodecylphenol

CAT: 0127-OR1078772-02Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR1078772-02Size:25 g

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CAS Number

5284-29-7

Synonyms

2-Laurylphenol

MDL Number

MFCD00020106

Purity

>98.0%

Smiles

CCCCCCCCCCCCC1=CC=CC=C1O

Chemical Information

2-Dodecylphenol

See also: Phenol, dodecyl- (annotation moved to).

CAS Number	5284-29-7
PubChem CID	171144
IUPAC Name	2-dodecylphenol
Molecular Formula	C18H30O
Molecular Weight	262.4
XLogP	7.8
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	11
Heavy Atom Count	19
Formal Charge	0
Complexity	190

SMILES

CCCCCCCCCCCCC1=CC=CC=C1O

InChI

InChI=1S/C18H30O/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)19/h12-13,15-16,19H,2-11,14H2,1H3

InChIKey

CYEJMVLDXAUOPN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5284-29-7

CID: 171144

Formula: C18H30O

MW: 262.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	262.4
XLogP3	7.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	11
Exact Mass	262.229665576
Monoisotopic Mass	262.229665576
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	190
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
OR1022917-01	4-Dodecylphenol
OR1027962-01	4-Dodecylphenol, Mixture Of Isomers
OR1055843-01	2- (4-Dodecylphenyl) -4,4,5,5-tetramethyl-1,3,2-dioxaborolane
OR1093224-01	1- (4-dodecylphenyl) ethanone
OR1058269-01	(4-Dodecylphenyl) boronic acid
PC1003049-01	2,2,2-Trifluoroethyl 2,2,2-trichloroacetate
OR1009873-01	2,2,2,2-Ethylenedinitrilotetraethanol
PC32719-01	2,2,2,2'-Tetrafluoroacetophenone
PC450293-01	2,2-Difluoroethyl 2,2,2-trifluoroethyl carbonate
PC6679-01	2- (2,2,2-Trifluoroethoxy) bromobenzene

Catalog	Name
sc-485455	2-Dodecylphenol
AAA10443-01	4-Dodecylphenol
TRC-D078105-10G	4-Dodecylphenol (Mixture Of Isomers)
D56630-01	P-Dodecylphenol 96.5%
sc-232638	4-Dodecylphenol, mixture of isomers
H 038-005	2'- , 2''-, 2''', 2'''', 2''''', 2''''''- Hexadeoxy- 2'-, 2'', 2''', 2'''', 2''''', 2''''''- hexafluoro- cyclic hexaadenosine monophosphate (2',2'',2''',2'''',2''''',2''''''-Hexa-F-c-hexadAMP / cFA6), sodium salt
TRC-T790200-50MG	2,2,2-Trifluoroethyl 2,5-Bis(2,2,2-trifluoroethoxy)benzoate
MBS6106553-01	2,2,2-Trifluoroethyl 2-Hydroxy-5-(2,2,2-trifluoroethoxy)benzoate
D443501	Diethyl-2,2,2,2',2',2'-d6-amine HCl
022261	2,2,2-Trifluoroethyl 2-Hydroxy-5- (2,2,2-trifluoroethoxy) benzoate