(4-azidophenyl)methanol

C7H7N3O — CID 11171062

IUPAC(4-azidophenyl)methanol
SMILES[N-]=[N+]=Nc1ccc(CO)cc1
InChIInChI=1S/C7H7N3O/c8-10-9-7-3-1-6(5-11)2-4-7/h1-4,11H,5H2
InChIKeyGEKVUCLUCOBNIE-UHFFFAOYSA-N
MW149.15 g/mol
LogP2.12
Rot. Bonds2

About (4-azidophenyl)methanol

(4-azidophenyl)methanol (PubChem CID 11171062) has the molecular formula C7H7N3O and a molecular weight of 149.15 g/mol. Its IUPAC name is (4-azidophenyl)methanol.

Molecular Properties

Compound Name(4-azidophenyl)methanol
PubChem CID11171062
Molecular FormulaC7H7N3O
Molecular Weight149.15 g/mol
Exact Mass149.06
IUPAC Name(4-azidophenyl)methanol
SMILES[N-]=[N+]=Nc1ccc(CO)cc1
InChIInChI=1S/C7H7N3O/c8-10-9-7-3-1-6(5-11)2-4-7/h1-4,11H,5H2
InChIKeyGEKVUCLUCOBNIE-UHFFFAOYSA-N
XLogP2.12
TPSA68.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.15
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

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CID 21439
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4-Dimethylaminobenzyl alcohol
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(4-[(E)-Phenyldiazenyl]phenyl)methanol
CID 555490
3-Aminobenzyl alcohol
CID 80293
4-Amino-alpha-methylbenzenemethanol
CID 85753
4-(Hydroxymethyl)benzenediazonium tetrafluoroborate
CID 21120209
4-(Hydroxymethyl)benzenediazonium
CID 122997
1-(4-(Hydroxymethyl)phenyl)guanidine
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(1S)-1-(4-aminophenyl)ethan-1-ol
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Frequently Asked Questions

What is the IUPAC name of (4-azidophenyl)methanol?
The IUPAC name of (4-azidophenyl)methanol (CID 11171062) is (4-azidophenyl)methanol.
What is the SMILES notation for (4-azidophenyl)methanol?
The canonical SMILES for (4-azidophenyl)methanol is [N-]=[N+]=Nc1ccc(CO)cc1.
What is the InChIKey of (4-azidophenyl)methanol?
The InChIKey is GEKVUCLUCOBNIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O/c8-10-9-7-3-1-6(5-11)2-4-7/h1-4,11H,5H2.
What are the key properties of (4-azidophenyl)methanol?
(4-azidophenyl)methanol has a molecular weight of 149.15 g/mol, XLogP of 2.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-azidophenyl)methanol is sourced from PubChem (CID 11171062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).