3-Butenoic acid,2,2-dimethyl-4-phenyl-

Modify Date: 2025-09-13 15:48:19

3-Butenoic acid,2,2-dimethyl-4-phenyl- Structure
3-Butenoic acid,2,2-dimethyl-4-phenyl- structure
 Common Name 3-Butenoic acid,2,2-dimethyl-4-phenyl-
CAS Number 4405-27-0 Molecular Weight 190.23800
Density 1.089g/cm3 Boiling Point 329ºC at 760mmHg
Molecular Formula C12H14O2 Melting Point N/A
MSDS N/A Flash Point 226ºC

 Names

Name 2,2-dimethyl-4-phenylbut-3-enoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.089g/cm3
Boiling Point 329ºC at 760mmHg
Molecular Formula C12H14O2
Molecular Weight 190.23800
Flash Point 226ºC
Exact Mass 190.09900
PSA 37.30000
LogP 2.81060
Index of Refraction 1.573
InChIKey AQDYAWVKFNARNE-UHFFFAOYSA-N
SMILES CC(C)(C=Cc1ccccc1)C(=O)O

 Safety Information

HS Code 2916399090

 Synthetic Route

3,3-Dimethyldihydro-2,5-furandione structure

3,3-Dimethyldih...

CAS#:17347-61-4

Benzaldehyde structure

Benzaldehyde

CAS#:100-52-7

~%

3-Butenoic acid,2,2-dimethyl-4-phenyl- Structure

3-Butenoic acid...

CAS#:4405-27-0

Literature: Marvell; Geiszler Journal of the American Chemical Society, 1952 , vol. 74, p. 1259,1262
3-CHLORO-3-METHYL BUTANONE structure

3-CHLORO-3-METH...

CAS#:5950-19-6

Benzaldehyde structure

Benzaldehyde

CAS#:100-52-7

~13%

3,3-dimethyl-5-phenyloxolan-2-one structure

3,3-dimethyl-5-...

CAS#:20215-55-8

N/A structure

N/A

CAS#:20099-28-9

Detail
Literature: Sakai, Takashi; Yamawaki, Akitoshi; Katayama, Tsuyoshi; Okada, Hiroshi; Utaka, Masanori; Takeda, Akira Bulletin of the Chemical Society of Japan, 1987 , vol. 60, # 3 p. 1067 - 1070
Ethyl 2-bromoisobutyrate structure

Ethyl 2-bromois...

CAS#:600-00-0

Phenylacetaldehyde structure

Phenylacetaldehyde

CAS#:122-78-1

~%

3-Butenoic acid,2,2-dimethyl-4-phenyl- Structure

3-Butenoic acid...

CAS#:4405-27-0

Literature: Bigley,D.B.; Thurman,J.C. Journal of the Chemical Society, 1965 , p. 6202 - 6205

 Customs

HS Code 2916399090
Summary 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

(E)-2,2-DIMETHYL-4-PHENYL-BUT-3-ENOIC ACID
3-Butenoic acid,2,2-dimethyl-4-phenyl
2,2-Dimethyl-4-phenyl-but-3-en-saeure
2,2-Dimethyl-4-phenyl-3-butenoic Acid
2,2-dimethyl-4-phenyl-but-3-enoic acid
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