My ChemCD

531-44-2
SCOPOLIN

Directory: 1. Identification; 2. Chemical and Physical Properties; 3. Material Safety Data Sheet(MSDS); 4. CML File; 5. TOP Suppliers; 6. Related products

Name

SCOPOLIN

Formula

C16 H18 O9

MolWeight

354.309

CCD No.

CCD00305837

CAS

531-44-2

MDL

MFCD02259444

1Identification

【Name】

SCOPOLIN

【CAS】

531-44-2

【MDL】

MFCD02259444

【English Synonyms】

SCOPOLIN

【Formula】

C16 H18 O9

【MolWeight】

354.309

【Inchi】

InChI=1S/C16H18O9/c1-22-9-4-7-2-3-12(18)23-8(7)5-10(9)24-16-15(21)14(20)13(19)11(6-17)25-16/h2-5,11,13-17,19-21H,6H2,1H3/t11-,13-,14+,15-,16-/m1/s1

【InChIKey】

InChIKey=SGTCGCCQZOUMJJ-YMILTQATSA-N

【SMILES】

COc1cc2ccc(=O)oc2cc1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O

【MOL File】

SCOPOLIN.mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:4

H bond acceptor:9

XLogP3:-1.0

Bulk/Fine:F

3Material Safety Data Sheet(MSDS)

4CML File

SCOPOLIN.cml

Quick Release

TOP Suppliers

ShangHai ChangYan Chem & Tech CO.,LTD
Catalog No:CY19604 10
Catalog No:CY19604 up to kgs
Country/Region:China
Business Type:Lab/Research institutions
http://www.changyanchem.com

Boc Sciences
Catalog No:531-44-2 up to kgs
Country/Region:United States
Business Type:Trading Company
https://www.bocsci.com/

AK Scientific, Inc.
Catalog No:W1273 nullnull
Country/Region:United States
Business Type:Others
http://www.aksci.com

Alfa Chemistry
Catalog No:ATM531442 up to kgs
Country/Region:United States
Business Type:Trading Company
https://www.alfa-chemistry.com

Wuhan Daybiochem Co., Ltd.
Catalog No:DAY63876 nullnull
Catalog No:DAY48703 nullnull
Country/Region:China
Business Type:Trading Company
http://www.daybiochem.com

More 531-44-2 Suppliers>>

531-44-2 SCOPOLIN

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】

【InChIKey】

【SMILES】

【MOL File】

2Chemical and Physical Properties

【Computed Properties】

3Material Safety Data Sheet(MSDS)

4CML File

TOP Suppliers

Related products

531-44-2
SCOPOLIN