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2-Chloro-5-(5,7-dimethyl-1,3-benzoxazol-2-yl)aniline

HCID 178590331
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Basic information

CAS
380582-37-6
Standard SMILES
Cc1cc(C)c2oc(-c3ccc(Cl)c(N)c3)nc2c1
InChIKey
VFZGPDYHAHRJMS-UHFFFAOYSA-N
Molecular formula
C15H13ClN2O
Average molar mass
272.73 g/mol
Monoisotopic mass
272.0716407

Names & identifiers

Preferred name
2-Chloro-5-(5,7-dimethyl-1,3-benzoxazol-2-yl)aniline
IUPAC
2-chloro-5-(5,7-dimethyl-1,3-benzoxazol-2-yl)aniline
English name
2-CHLORO-5-(5,7-DIMETHYL-1,3-BENZOXAZOL-2-YL)ANILINE
Molecular formula
C15H13ClN2O
Molecular weight
272.73

Names & synonyms

2-chloro-5-(5,7-dimethyl-1,3-benzoxazol-2-yl)aniline380582-37-62-chloro-5-(5,7-dimethylbenzo[d]oxazol-2-yl)anilinestarbld0013352Oprea1_002487SCHEMBL2249546BBL008060MFCD02628443STK112663AKOS000108351VS-01808CS-0332508
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AKOS BB-8199ASISCHEM T30966TIMTEC-BB SBB009768ART-CHEM-BB B0252372-CHLORO-5-(5,7-DIMETHYL-BENZOOXAZOL-2-YL)-PHENYLAMINE
ST500186155-(5,7-dimethylbenzoxazol-2-yl)-2-chlorophenylamine

Database identifiers

CAS
380582-37-6
PubChem CID
880852

Properties

Computed structural propertiesFilling in

XLogP
4.1
Topological polar surface area
52.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
19
Formal charge
0
Complexity
327

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