5-(4-(Difluoromethoxy)phenyl)-2H-tetrazole

HCID 4912904

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Basic information

CAS: 832740-88-2
Standard SMILES: FC(F)Oc1ccc(-c2nn[nH]n2)cc1
InChIKey: RUBKYAZIXMYFTQ-UHFFFAOYSA-N
Molecular formula: C8H6F2N4O
Average molar mass: 212.16 g/mol
Monoisotopic mass: 212.05096715

Names & identifiers

Preferred name: 5-(4-(Difluoromethoxy)phenyl)-2H-tetrazole
IUPAC: 5-[4-(difluoromethoxy)phenyl]-2H-tetrazole

Names & synonyms

832740-88-25-[4-(difluoromethoxy)phenyl]-2H-tetrazole5-(4-(Difluoromethoxy)phenyl)-2H-tetrazoleRefChem:2997745-(4-Difluoromethoxy-phenyl)-2H-tetrazole2h-tetrazole, 5-[4-(difluoromethoxy)phenyl]-(4-(2H-1,2,3,4-tetraazol-5-yl)phenoxy)difluoromethane5-[4-(DIFLUOROMETHOXY)PHENYL]-2H-1,2,3,4-TETRAZOLESCHEMBL13113064RUBKYAZIXMYFTQ-UHFFFAOYSA-NDTXSID101268496HIB74088

Show more names

MFCD04969861SBB013468STK313242AKOS000310209ST41250385-[4-(Difluoromethoxy)phenyl]-1H-tetrazoleCS-0240670ST45092453

Database identifiers

CAS: 832740-88-2
PubChem CID: 4912904
DTXSID: DTXSID101268496

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 63.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 199

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