CAS
95192-59-9 Purity
96%
95192-59-9 Purity
96%
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2-Iodo-4,6-dinitrobenzoic acid
CAS
95192-62-4
Catalog Number
ACM95192624
Category
Other Products
Molecular Weight
338.01
Molecular Formula
C7H3IN2O6
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Specification
Synonyms
4,6-DINITRO-2-IODOBENZOIC ACID;4,6-DINITRO-4-IODOBENZOIC ACID
IUPAC Name
2-iodo-4,6-dinitrobenzoic acid
Canonical SMILES
C1=C(C=C(C(=C1[N+](=O)[O-])C(=O)O)I)[N+](=O)[O-]
InChI Key
BPRWITXLBDMESL-UHFFFAOYSA-N
Boiling Point
445.2ºC at 760 mmHg
Flash Point
223.1ºC
Density
2.288g/cm³
Exact Mass
337.90400
H-Bond Acceptor
6
H-Bond Donor
1
What is the molecular formula of 2-Iodo-4,6-dinitrobenzoic acid?
The molecular formula of 2-Iodo-4,6-dinitrobenzoic acid is C7H3IN2O6.
When was 2-Iodo-4,6-dinitrobenzoic acid created in PubChem?
2-Iodo-4,6-dinitrobenzoic acid was created in PubChem on July 19, 2005.
What is the molecular weight of 2-Iodo-4,6-dinitrobenzoic acid?
The molecular weight of 2-Iodo-4,6-dinitrobenzoic acid is 338.01 g/mol.
What is the InChIKey for 2-Iodo-4,6-dinitrobenzoic acid?
The InChIKey for 2-Iodo-4,6-dinitrobenzoic acid is BPRWITXLBDMESL-UHFFFAOYSA-N.
How many hydrogen bond acceptors does 2-Iodo-4,6-dinitrobenzoic acid have?
2-Iodo-4,6-dinitrobenzoic acid has 6 hydrogen bond acceptors.
What is the exact mass of 2-Iodo-4,6-dinitrobenzoic acid?
The exact mass of 2-Iodo-4,6-dinitrobenzoic acid is 337.90358 g/mol.
How many heavy atoms are present in 2-Iodo-4,6-dinitrobenzoic acid?
There are 16 heavy atoms present in 2-Iodo-4,6-dinitrobenzoic acid.
Is 2-Iodo-4,6-dinitrobenzoic acid a canonicalized compound?
Yes, 2-Iodo-4,6-dinitrobenzoic acid is a canonicalized compound.
Does 2-Iodo-4,6-dinitrobenzoic acid have any defined atom stereocenters?
No, 2-Iodo-4,6-dinitrobenzoic acid does not have any defined atom stereocenters.
How many rotatable bonds does 2-Iodo-4,6-dinitrobenzoic acid have?
2-Iodo-4,6-dinitrobenzoic acid has 1 rotatable bond.
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