trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide

C10H11BF3- — CID 63677195

IUPACtrifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide
SMILESF[B-](F)(F)c1cccc2c1CCCC2
InChIInChI=1S/C10H11BF3/c12-11(13,14)10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7H,1-2,4,6H2/q-1
InChIKeyWRSUYSWJPDXNFH-UHFFFAOYSA-N
MW199.00 g/mol
LogP2.62
Rot. Bonds1

About trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide

trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide (PubChem CID 63677195) has the molecular formula C10H11BF3- and a molecular weight of 199.00 g/mol. Its IUPAC name is trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide.

Molecular Properties

Compound Nametrifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide
PubChem CID63677195
Molecular FormulaC10H11BF3-
Molecular Weight199.00 g/mol
Exact Mass199.09
IUPAC Nametrifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide
SMILESF[B-](F)(F)c1cccc2c1CCCC2
InChIInChI=1S/C10H11BF3/c12-11(13,14)10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7H,1-2,4,6H2/q-1
InChIKeyWRSUYSWJPDXNFH-UHFFFAOYSA-N
XLogP2.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.00
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

5,6,7,8,9,10,11,12-octahydrobenzo[10]annulen-4-ol
CID 21151081
5-(difluoromethyl)-1,2,3,4-tetrahydronaphthalene
CID 159912774
3,6-bis(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2,4,5-tetrazine
CID 146453462
N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine
CID 71344847
4-(trifluoromethyl)-2,3-dihydro-1H-indene
CID 126626843
methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane
CID 170002803
1,2,3,4-tetrahydronaphthalene
CID 174531863
4-phosphoroso-6,7,8,9-tetrahydro-5H-benzo[7]annulene
CID 154973128
phosphoric acid;5-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2,3,4-tetrahydronaphthalene
CID 23110735
4-methoxy-5,6,7,8,9,10-hexahydrobenzo[8]annulene
CID 153201426
1-propan-2-yl-1-(5,6,7,8-tetrahydronaphthalen-1-yl)hydrazine
CID 102329971
1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-one
CID 14994244

Frequently Asked Questions

What is the IUPAC name of trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide?
The IUPAC name of trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide (CID 63677195) is trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide.
What is the SMILES notation for trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide?
The canonical SMILES for trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide is F[B-](F)(F)c1cccc2c1CCCC2.
What is the InChIKey of trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide?
The InChIKey is WRSUYSWJPDXNFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BF3/c12-11(13,14)10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7H,1-2,4,6H2/q-1.
What are the key properties of trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide?
trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide has a molecular weight of 199.00 g/mol, XLogP of 2.62, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trifluoro(5,6,7,8-tetrahydronaphthalen-1-yl)boranuide is sourced from PubChem (CID 63677195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).