CAS
93982-97-9 Purity
96%
93982-97-9 Purity
96%
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Potassium 2-(4-chlorophenyl)benzoxazole-5-propionate
CAS
93983-00-7
Catalog Number
ACM93983007
Category
Other Products
Molecular Weight
339.814740 [g/mol]
Molecular Formula
C16H11ClKNO3
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Specification
Synonyms
EINECS 301-287-8, Potassium 2-(4-chlorophenyl)benzoxazole-5-propionate, 93983-00-7
IUPAC Name
potassium 3-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]propanoate
Canonical SMILES
C1=CC(=CC=C1C2=NC3=C(O2)C=CC(=C3)CCC(=O)[O-])Cl.[K+]
InChI Key
RRYBJWUKCHIDNI-UHFFFAOYSA-M
Boiling Point
446.2ºC at 760mmHg
Flash Point
223.6ºC
EC Number
301-287-8
Exact Mass
339.00600
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of Potassium 2-(4-chlorophenyl)benzoxazole-5-propionate?
The molecular formula is C16H11ClKNO3.
When was Potassium 2-(4-chlorophenyl)benzoxazole-5-propionate created?
It was created on 2008-02-05.
What is the IUPAC name of Potassium 2-(4-chlorophenyl)benzoxazole-5-propionate?
The IUPAC name is potassium;3-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]propanoate.
What is the InChIKey of Potassium 2-(4-chlorophenyl)benzoxazole-5-propionate?
The InChIKey is RRYBJWUKCHIDNI-UHFFFAOYSA-M.
How many hydrogen bond acceptors are present in Potassium 2-(4-chlorophenyl)benzoxazole-5-propionate?
There are 4 hydrogen bond acceptors.
What is the exact mass of Potassium 2-(4-chlorophenyl)benzoxazole-5-propionate?
The exact mass is 339.0064524 g/mol.
How many rotatable bond counts are there in Potassium 2-(4-chlorophenyl)benzoxazole-5-propionate?
There are 4 rotatable bond counts.
What is the complexity of Potassium 2-(4-chlorophenyl)benzoxazole-5-propionate?
The complexity is 376.
How many covalently-bonded unit counts are present in Potassium 2-(4-chlorophenyl)benzoxazole-5-propionate?
There are 2 covalently-bonded unit counts.
Is Potassium 2-(4-chlorophenyl)benzoxazole-5-propionate a canonicalized compound?
Yes, it is canonicalized.
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