2-bromonaphthalene;phenol

C16H13BrO — CID 174920874

IUPAC2-bromonaphthalene;phenol
SMILESBrc1ccc2ccccc2c1.Oc1ccccc1
InChIInChI=1S/C10H7Br.C6H6O/c11-10-6-5-8-3-1-2-4-9(8)7-10;7-6-4-2-1-3-5-6/h1-7H;1-5,7H
InChIKeyIAMWZOZPWYMRPC-UHFFFAOYSA-N
MW301.18 g/mol
LogP4.99
Rot. Bonds

About 2-bromonaphthalene;phenol

2-bromonaphthalene;phenol (PubChem CID 174920874) has the molecular formula C16H13BrO and a molecular weight of 301.18 g/mol. Its IUPAC name is 2-bromonaphthalene;phenol.

Molecular Properties

Compound Name2-bromonaphthalene;phenol
PubChem CID174920874
Molecular FormulaC16H13BrO
Molecular Weight301.18 g/mol
Exact Mass300.01
IUPAC Name2-bromonaphthalene;phenol
SMILESBrc1ccc2ccccc2c1.Oc1ccccc1
InChIInChI=1S/C10H7Br.C6H6O/c11-10-6-5-8-3-1-2-4-9(8)7-10;7-6-4-2-1-3-5-6/h1-7H;1-5,7H
InChIKeyIAMWZOZPWYMRPC-UHFFFAOYSA-N
XLogP4.99
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.18
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-bromonaphthalene
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anthracene;benzene;naphthalene;phenol
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2-bromonaphthalene;sulfuryl dichloride
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naphthalen-2-ol
CID 71750931
1,1'-biphenyl;naphthalene;phenol
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CID 69280188
CID 69280188
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CID 171457187
2-bromo-6-phenylmethoxynaphthalene
CID 640595
ethane;naphthalen-2-ol
CID 91107047
3-bromoanthracen-9-ol
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Frequently Asked Questions

What is the IUPAC name of 2-bromonaphthalene;phenol?
The IUPAC name of 2-bromonaphthalene;phenol (CID 174920874) is 2-bromonaphthalene;phenol.
What is the SMILES notation for 2-bromonaphthalene;phenol?
The canonical SMILES for 2-bromonaphthalene;phenol is Brc1ccc2ccccc2c1.Oc1ccccc1.
What is the InChIKey of 2-bromonaphthalene;phenol?
The InChIKey is IAMWZOZPWYMRPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7Br.C6H6O/c11-10-6-5-8-3-1-2-4-9(8)7-10;7-6-4-2-1-3-5-6/h1-7H;1-5,7H.
What are the key properties of 2-bromonaphthalene;phenol?
2-bromonaphthalene;phenol has a molecular weight of 301.18 g/mol, XLogP of 4.99, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromonaphthalene;phenol is sourced from PubChem (CID 174920874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).