4-(Hydroxymethyl)-1H-indazole - CAS 709608-85-5

Name: 4-(Hydroxymethyl)-1H-indazole
Brand: BOC Sciences
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Catalog:	BB034275
Product Name:	4-(Hydroxymethyl)-1H-indazole
CAS:	709608-85-5
Synonyms:	1H-indazol-4-ylmethanol; 1H-indazol-4-ylmethanol

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Computed Properties

IUPAC Name:	1H-indazol-4-ylmethanol
Description:	4-(Hydroxymethyl)-1H-indazole (CAS# 709608-85-5) is a useful research chemical compound.
Molecular Weight:	148.16
Molecular Formula:	C8H8N2O
Canonical SMILES:	C1=CC(=C2C=NNC2=C1)CO
InChI:	InChI=1S/C8H8N2O/c11-5-6-2-1-3-8-7(6)4-9-10-8/h1-4,11H,5H2,(H,9,10)
InChI Key:	LOOWJTAKSUNLSR-UHFFFAOYSA-N
Boiling Point:	380.3 °C at 760 mmHg
Density:	1.36 g/cm³
Appearance:	Brown solid
LogP:	1.05520

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

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Complexity:	140
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	148.063662883
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	148.063662883
Rotatable Bond Count:	1
Topological Polar Surface Area:	48.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.7