CAS
915920-96-6 Purity
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915920-96-6 Purity
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Chembrdg-bb 7994823
CAS
915921-00-5
Catalog Number
ACM915921005
Category
Other Products
Molecular Formula
C11H12O4S
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Specification
Synonyms
CHEMBRDG-BB 7994823;3-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YLTHIO)PROPANOIC ACID
What is the molecular formula of Chembrdg-bb 7994823?
The molecular formula of Chembrdg-bb 7994823 is C11H12O4S.
When was Chembrdg-bb 7994823 created in PubChem?
Chembrdg-bb 7994823 was created in PubChem on May 28, 2009.
What is the molecular weight of Chembrdg-bb 7994823?
The molecular weight of Chembrdg-bb 7994823 is 240.28 g/mol.
What is the IUPAC name of Chembrdg-bb 7994823?
The IUPAC name of Chembrdg-bb 7994823 is 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoic acid.
What is the InChIKey of Chembrdg-bb 7994823?
The InChIKey of Chembrdg-bb 7994823 is LMJJCUHBJIXUHM-UHFFFAOYSA-N.
What is the Canonical SMILES representation of Chembrdg-bb 7994823?
The Canonical SMILES representation of Chembrdg-bb 7994823 is C1COC2=C(O1)C=CC(=C2)SCCC(=O)O.
How many hydrogen bond donor counts are there in Chembrdg-bb 7994823?
There is 1 hydrogen bond donor count in Chembrdg-bb 7994823.
What is the XLogP3-AA value of Chembrdg-bb 7994823?
The XLogP3-AA value of Chembrdg-bb 7994823 is 1.6.
Is the compound canonicalized in Chembrdg-bb 7994823?
Yes, the compound is canonicalized in Chembrdg-bb 7994823.
What is the topological polar surface area of Chembrdg-bb 7994823?
The topological polar surface area of Chembrdg-bb 7994823 is 81.1 Ų.
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