CAS
953-38-8 Purity
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953-38-8 Purity
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4-Chloro resorcinol-13c6
CAS
953390-32-4
Catalog Number
ACM953390324
Category
Other Products
Molecular Weight
150.51
Molecular Formula
13C6H5ClO2
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Specification
Synonyms
4-Chloro-1,3-benzenediol-1,2,3,4,5,6-13C6; 2,4-Dihydroxychlorobenzene-13C6; 4-Chloro-1,3-dihydroxybenzene-13C6; 4-Chlororesorcin-13C6; 6-Chlororesorcinol-13C6; p-Chlororesorcinol-
IUPAC Name
4-chlorobenzene-1,3-diol
SMILES
C1=CC(=C(C=C1O)O)Cl
InChI Key
JQVAPEJNIZULEK-IDEBNGHGSA-N
Appearance
White Solid
Exact Mass
150.01800
H-Bond Acceptor
2
H-Bond Donor
2
What is the molecular formula of 4-Chloro resorcinol-13c6?
The molecular formula is C6H5ClO2.
When was 4-Chloro resorcinol-13c6 created?
It was created on February 5, 2007.
What is the IUPAC name of 4-Chloro resorcinol-13c6?
The IUPAC name is 4-chloro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1,3-diol.
What is the InChIKey of 4-Chloro resorcinol-13c6?
The InChIKey is JQVAPEJNIZULEK-IDEBNGHGSA-N.
How many hydrogen bond donor counts does 4-Chloro resorcinol-13c6 have?
It has 2 hydrogen bond donor counts.
What is the XLogP3 value of 4-Chloro resorcinol-13c6?
The XLogP3 value is 2.1.
What is the exact mass of 4-Chloro resorcinol-13c6?
The exact mass is 150.0179361 g/mol.
How many isotope atom counts does 4-Chloro resorcinol-13c6 have?
It has 6 isotope atom counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the topological polar surface area of 4-Chloro resorcinol-13c6?
The topological polar surface area is 40.5 Å2.
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