1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)-

Modify Date: 2024-01-05 18:06:06

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- Structure
1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- structure
 Common Name 1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)-
CAS Number 127-25-3 Molecular Weight 316.47800
Density 1.02g/cm3 Boiling Point 403.8ºC at 760mmHg
Molecular Formula C21H32O2 Melting Point N/A
MSDS N/A Flash Point 192.8ºC

 Names

Name methyl abietate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.02g/cm3
Boiling Point 403.8ºC at 760mmHg
Molecular Formula C21H32O2
Molecular Weight 316.47800
Flash Point 192.8ºC
Exact Mass 316.24000
PSA 26.30000
LogP 5.29460
Vapour Pressure 9.9E-07mmHg at 25°C
Index of Refraction 1.521

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TP8590000
CHEMICAL NAME :
Podocarpa-7,13-dien-15-oic acid, 13-isopropyl-, methyl ester
CAS REGISTRY NUMBER :
127-25-3
BEILSTEIN REFERENCE NO. :
2702228
LAST UPDATED :
199701
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C21-H32-O2
MOLECULAR WEIGHT :
316.53
WISWESSER LINE NOTATION :
L B666 EU GUTJ A1 EY1&1 KVO1 K1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 12,931,1974 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 12,931,1974
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 12,931,1974 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 83115 No. of Facilities: 2499 (estimated) No. of Industries: 25 No. of Occupations: 26 No. of Employees: 23335 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 83115 No. of Facilities: 468 (estimated) No. of Industries: 5 No. of Occupations: 15 No. of Employees: 5251 (estimated) No. of Female Employees: 1791 (estimated)

 Synthetic Route

abietic acid structure

abietic acid

CAS#:514-10-3

Dimethyl sulfate structure

Dimethyl sulfate

CAS#:77-78-1

~99%

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- Structure

1-Phenanthrenec...

CAS#:127-25-3

Literature: Zhou, Bing; Li, Xiaomei; Feng, Huijin; Li, Yuanchao Tetrahedron, 2010 , vol. 66, # 29 p. 5396 - 5401
diazomethane structure

diazomethane

CAS#:186581-53-3

abietic acid structure

abietic acid

CAS#:514-10-3

~99%

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- Structure

1-Phenanthrenec...

CAS#:127-25-3

Literature: Dos Santos, Catarina; De Rosso, Cesar R.S.; Imamura, Paulo M. Synthetic Communications, 1999 , vol. 29, # 11 p. 1903 - 1910
Methanol structure

Methanol

CAS#:67-56-1

abietic acid structure

abietic acid

CAS#:514-10-3

~84%

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- Structure

1-Phenanthrenec...

CAS#:127-25-3

Literature: Morcillo, Sara P.; Alvarez De Cienfuegos, Luis; Mota, Antonio J.; Justicia, Jose; Robles, Rafael Journal of Organic Chemistry, 2011 , vol. 76, # 7 p. 2277 - 2281
Dimethyl sulfone structure

Dimethyl sulfone

CAS#:67-71-0

abietic acid structure

abietic acid

CAS#:514-10-3

~84%

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- Structure

1-Phenanthrenec...

CAS#:127-25-3

Literature: Cambie, Richard C.; Rutledge, Peter S.; Ryan, Glen R.; Strange, Gary A.; Woodgate, Paul D. Australian Journal of Chemistry, 1990 , vol. 43, # 5 p. 867 - 881
abietic acid structure

abietic acid

CAS#:514-10-3

methyl iodide structure

methyl iodide

CAS#:74-88-4

~91%

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- Structure

1-Phenanthrenec...

CAS#:127-25-3

Literature: Rafferty, Ryan J.; Hicklin, Robert W.; Maloof, Katherine A.; Hergenrother, Paul J. Angewandte Chemie - International Edition, 2014 , vol. 53, # 1 p. 220 - 224 Angew. Chem., 2014 , vol. 126, # 1 p. 224 - 228,5
Methanol structure

Methanol

CAS#:67-56-1

Abietic anhydride structure

Abietic anhydride

CAS#:19897-44-0

~49%

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- Structure

1-Phenanthrenec...

CAS#:127-25-3

Literature: Bardyshev Russian Journal of Organic Chemistry, 1999 , vol. 35, # 1 p. 41 - 55
abietic acid structure

abietic acid

CAS#:514-10-3

(Trimethylsilyl)diazomethane structure

(Trimethylsilyl...

CAS#:18107-18-1

~94%

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- Structure

1-Phenanthrenec...

CAS#:127-25-3

Literature: Presser, Armin; Huefner, Antje Monatshefte fur Chemie, 2004 , vol. 135, # 8 p. 1015 - 1022
abietic acid sodium salt structure

abietic acid so...

CAS#:14351-66-7

~%

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- Structure

1-Phenanthrenec...

CAS#:127-25-3

Literature: Russian Journal of Organic Chemistry, , vol. 35, # 1 p. 41 - 55
Dimethyl sulfate structure

Dimethyl sulfate

CAS#:77-78-1

~%

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- Structure

1-Phenanthrenec...

CAS#:127-25-3

Literature: Chemische Berichte, , vol. 64, p. 2441,2445

 Synonyms

abieticacid,methylester
Methyl rosinate
methyl (-)-abietate
methyl abietadien-19-oate
Abietic acid methyl
ABALYN
woodrosin,methylester
methylesterofwoodrosin
methyl abieta-7,13-dien-18-oate
Methyl resinate
METHYL ESTER OF ROSIN
EINECS 204-832-7
methyl abietadien-18-oate
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1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- suppliers

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)- price

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Chemsrc provides CAS#:127-25-3 MSDS, density, melting point, boiling point, structure, etc. Its name is 1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)->> amp version: 1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,methyl ester, (1R,4aR,4bR,10aR)-

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