CAS
98951-18-9 Purity
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98951-18-9 Purity
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4-(dimethylamino)-3-iodobenzoic acid
CAS
98952-63-7
Catalog Number
ACM98952637
Category
Other Products
Molecular Weight
291.085670 [g/mol]
Molecular Formula
C9H10INO2
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Specification
Synonyms
4-(dimethylamino)-3-iodobenzoic acid, 98952-63-7, CTK8E2538, SBB067878, AKOS015850713, 4-(dimethylamino)-3-iodo-benzoic acid, 4-(dimethylamino)-3-iodanyl-benzoic acid, AK130394, KB-145201, FT-0653602, A845933, I14-5358
IUPAC Name
4-(dimethylamino)-3-iodobenzoic acid
Canonical SMILES
CN(C)C1=C(C=C(C=C1)C(=O)O)I
InChI Key
SIBQOMKKIJDSDW-UHFFFAOYSA-N
Boiling Point
376.892ºC at 760 mmHg
Flash Point
181.738ºC
Density
1.797g/cm³
Exact Mass
290.97600
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 4-(dimethylamino)-3-iodobenzoic acid?
The molecular formula of 4-(dimethylamino)-3-iodobenzoic acid is C9H10INO2.
When was 4-(dimethylamino)-3-iodobenzoic acid created and modified in PubChem?
It was created on 2010-03-23 and modified on 2023-12-30.
What is the IUPAC name of 4-(dimethylamino)-3-iodobenzoic acid?
The IUPAC name of 4-(dimethylamino)-3-iodobenzoic acid is 4-(dimethylamino)-3-iodobenzoic acid.
What is the InChIKey of 4-(dimethylamino)-3-iodobenzoic acid?
The InChIKey of 4-(dimethylamino)-3-iodobenzoic acid is SIBQOMKKIJDSDW-UHFFFAOYSA-N.
What is the canonical SMILES of 4-(dimethylamino)-3-iodobenzoic acid?
The canonical SMILES of 4-(dimethylamino)-3-iodobenzoic acid is CN(C)C1=C(C=C(C=C1)C(=O)O)I.
What is the molecular weight of 4-(dimethylamino)-3-iodobenzoic acid?
The molecular weight of 4-(dimethylamino)-3-iodobenzoic acid is 291.09 g/mol.
What is the CAS number of 4-(dimethylamino)-3-iodobenzoic acid?
The CAS number of 4-(dimethylamino)-3-iodobenzoic acid is 98952-63-7.
How many hydrogen bond donor counts does 4-(dimethylamino)-3-iodobenzoic acid have?
4-(dimethylamino)-3-iodobenzoic acid has 1 hydrogen bond donor count.
What is the topological polar surface area of 4-(dimethylamino)-3-iodobenzoic acid?
The topological polar surface area of 4-(dimethylamino)-3-iodobenzoic acid is 40.5 Ų.
Is 4-(dimethylamino)-3-iodobenzoic acid a canonicalized compound in PubChem?
Yes, 4-(dimethylamino)-3-iodobenzoic acid is a canonicalized compound in PubChem.
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