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CHORISMIC ACID structure, CAS 617-12-9

CHORISMIC ACID

CAS Number617-12-9

Synonyms(3R,4R)-3-<1-Carboxy-vinyloxy>-4-hydroxy-3,4-dihydro-benzoesaeure,Chorisminsaeure; Chorismic acid; (-)-chaparrinone; Chorisminsaeure,trans-3,4-Dihydroxy-cyclohexa-1,5-diencarbonsaeure-3-enolbrenztraubensaeureether; (3R,4R)-3-<1-Carboxy-vinyloxy>-4-hydroxy-3,4-dihydro-benzoesaeure

Molecular FormulaC10H10O6

Molecular Weight226.18

Purity≥80%

Density1.49g/cm3

Boiling Point556.1ºC at 760 mmHg

Melting Point105-108ºC

Flash Point

Appearancepowder

EINECS

MSDSChineseEnglish

Symboltransportation

Signal WordWarning

Cat. No.: 2A-9093045 Purity: ≥80%
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Quality Control of [ 617-12-9 ] Purity: ≥80% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number617-12-9
Catalog No.2A-9093045
Chinese Name分支酸 来源于产气肠杆菌
Synonyms(3R,4R)-3-<1-Carboxy-vinyloxy>-4-hydroxy-3,4-dihydro-benzoesaeure,Chorisminsaeure; Chorismic acid; (-)-chaparrinone; Chorisminsaeure,trans-3,4-Dihydroxy-cyclohexa-1,5-diencarbonsaeure-3-enolbrenztraubensaeureether; (3R,4R)-3-<1-Carboxy-vinyloxy>-4-hydroxy-3,4-dihydro-benzoesaeure
Molecular FormulaC10H10O6
Molecular Weight226.18
Purity≥80
Density1.49g/cm3
Boiling Point556.1ºC at 760 mmHg
Melting Point105-108ºC
Appearancepowder
Storage Condition20°C
PubChem ID57653988
MDL NumberMFCD00135935
SMILESO[C@@H]1C=CC(=C[C@H]1OC(=C)C(O)=O)C(O)=O
InChI1S/C10H10O6/c1-5(9(12)13)16-8-4-6(10(14)15)2-3-7(8)11/h2-4,7-8,11H,1H2,(H,12,13)(H,14,15)/t7-,8-/m1/s1
InChI KeyWTFXTQVDAKGDEY-HTQZYQBOSA-N
NACRES CodeNA.22
UNSPSC12352100
Hazard Symbolstransportation
MSDSmsds/93045_1_617_12_9.pdf
Transport InfoProduct name: Purity: 80.0%
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available
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