HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

2-Chloro-3,5-diiodobenzoic acid

HCID 84893
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
15396-36-8
Standard SMILES
O=C(O)c1cc(I)cc(I)c1Cl
InChIKey
ZNJCYNGNDYEMAA-UHFFFAOYSA-N
Molecular formula
C7H3ClI2O2
Average molar mass
408.36 g/mol
Monoisotopic mass
407.7911

Names & identifiers

Preferred name
2-Chloro-3,5-diiodobenzoic acid
IUPAC
2-chloro-3,5-diiodobenzoic acid
English name
2-chloro-3,5-diiodobenzoic acid
Molecular formula
C7H3ClI2O2
Molecular weight
0

Names & synonyms

2-Chloro-3,5-diiodobenzoic acid15396-36-8EINECS 239-416-4DTXSID70934883RefChem:86164DTXCID201363524239-416-456HPV5G7UYZNJCYNGNDYEMAA-UHFFFAOYSA-NAKOS000109231Benzoic acid, 2-chloro-3,5-diiodo-NS00052775
Show more names
Empagliflozin Impurity 1802-chloro-3,5-diiodobenzoic acidQ: What is 2-chloro-3,5-diiodobenzoic acid Q: What is the CAS Number of 2-chloro-3,5-diiodobenzoic acid

Database identifiers

CAS
15396-36-8
PubChem CID
84893
DTXSID
DTXSID70934883
UNII
56HPV5G7UY
EC Number
239-416-4
Nikkaji
J218.416H

Properties

Computed structural properties

XLogP
5
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
188

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes