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Benzoxazole, 2-(3,4-dichlorophenyl)-

HCID 18485
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Basic information

CAS
3164-12-3
Standard SMILES
Clc1ccc(-c2nc3ccccc3o2)cc1Cl
InChIKey
DSLOEULHWIEJEX-UHFFFAOYSA-N
Molecular formula
C13H7Cl2NO
Average molar mass
264.1 g/mol
Monoisotopic mass
262.9904692

Names & identifiers

Preferred name
Benzoxazole, 2-(3,4-dichlorophenyl)-
IUPAC
2-(3,4-dichlorophenyl)-1,3-benzoxazole
English name
2-(3,4-Dichlorophenyl)benzoxazole
Molecular formula
C13H7Cl2NO
Molecular weight
264.11

Names & synonyms

2-(3,4-Dichlorophenyl)benzoxazole3164-12-3R.656BENZOXAZOLE, 2-(3,4-DICHLOROPHENYL)-BRN 0206445DTXSID801855264-27-00-01384 (Beilstein Handbook Reference)RefChem:328255DTXCID201080172-(3,4-dichlorophenyl)-1,3-benzoxazole2-(3,4-dichlorophenyl)benzo[d]oxazoleSCHEMBL11556101
Show more names
SCHEMBL30522740STK258668AKOS000460474DB-086729AN-979/41713830

Database identifiers

CAS
3164-12-3
PubChem CID
18485
DTXSID
DTXSID80185526
Nikkaji
J41.877C

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
26 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
17
Formal charge
0
Complexity
276

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