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52029-86-4
7-OXO-7H-BENZIMIDAZO[2,1-A]BENZ[DE]ISOQUINOLINE-3-CARBOXYLIC ACID ACETATE
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1. Identification
2. Chemical and Physical Properties
3. Material Safety Data Sheet(MSDS)
4. CML File
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Name
7-OXO-7H-BENZIMIDAZO[2,1-A]BENZ[DE]ISOQUINOLINE-3-CARBOXYLIC ACID ACETATE
Formula
C19 H10 N2 O3 . C2 H4 O2
MolWeight
374.351
CCD No.
CCD00542392
CAS
52029-86-4
MDL
MFCD06411456
1
Identification
【Name】
7-OXO-7H-BENZIMIDAZO[2,1-A]BENZ[DE]ISOQUINOLINE-3-CARBOXYLIC ACID ACETATE
【CAS】
52029-86-4
【MDL】
MFCD06411456
【English Synonyms】
STO-609
STO-609-ACETIC ACID
7-OXO-7H-BENZIMIDAZO[2,1-A]BENZ[DE]ISOQUINOLINE-3-CARBOXYLIC ACID ACETATE
7H-BENZ[DE]BENZIMIDAZO[2,1-A]ISOQUINOLINE-7-ONE-3-CARBOXYLIC ACID, ACETATE
7-OXO-7H-BENZIMIDAZO[2,1-A]BENZ[DE]ISOQUINOLINE-3-CARBOXYLIC ACID-ACETIC ACID
STO-609 ACETATE
【Formula】
C19 H10 N2 O3 . C2 H4 O2
【MolWeight】
374.351
【Inchi】
InChI=1S/C19H10N2O3.C2H4O2/c22-18-13-5-3-4-10-11(19(23)24)8-9-12(16(10)13)17-20-14-6-1-2-7-15(14)21(17)18;1-2(3)4/h1-9H,(H,23,24);1H3,(H,3,4)
【InChIKey】
InChIKey=WNRSTFUVBWNELX-UHFFFAOYSA-N
【SMILES】
CC(=O)O.c1ccc2c(c1)nc3n2c(=O)c4cccc5c4c3ccc5C(=O)O
【MOL File】
7-OXO-7H-BENZIMIDAZO….mol
2
Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3
Material Safety Data Sheet(MSDS)
【WGK Germany】
3
4
CML File
7-OXO-7H-BENZIMIDAZO[2,1-A]BENZ[DE]ISOQUINOLINE-3-CARBOXYLIC ACID ACETATE.cml
Quick Release
TOP Suppliers
Porse Fine Chemical Co., Ltd.
Catalog No:
PS-BI-1903
nullnull
Catalog No:
PS-PR-2674
nullnull
Country/Region:China
Business Type:Lab/Research institutions
http://www.porsefinechemical.com
Porse Fine Chemical (Shenzhen) Co., Ltd.
Catalog No:
PS-BI-1903
Catalog No:
PS-PR-2674
Country/Region:China
Business Type:Lab/Research institutions
http://www.porsefinechemical.com
Boc Sciences
Catalog No:
52029-86-4
up to kgs
Country/Region:United States
Business Type:Trading Company
https://www.bocsci.com/
EMD Biosciences, Inc.
Catalog No:
570250
5MG
Country/Region:United States
Business Type:Others
http://www.calbiochem.com
Alfa Chemistry
Catalog No:
ACM52029864
nullnull
Catalog No:
ATM52029864
up to kgs
Country/Region:United States
Business Type:Trading Company
https://www.alfa-chemistry.com
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