3-Bromo-1-methylindazole - CAS 326474-67-3

Catalog:	BB021356
Product Name:	3-Bromo-1-methylindazole
CAS:	326474-67-3
Synonyms:	3-bromo-1-methylindazole

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Computed Properties

IUPAC Name:	3-bromo-1-methylindazole
Description:	3-Bromo-1-methylindazole (CAS# 326474-67-3) is a useful research chemical for organic synthesis and other chemical processes.
Molecular Weight:	211.06
Molecular Formula:	C8H7BrN2
Canonical SMILES:	CN1C2=CC=CC=C2C(=N1)Br
InChI:	InChI=1S/C8H7BrN2/c1-11-7-5-3-2-4-6(7)8(9)10-11/h2-5H,1H3
InChI Key:	NRDWKILCVWZZDP-UHFFFAOYSA-N
MDL:	MFCD12923368
LogP:	2.33580

Publication Number	Title	Priority Date
CN-110128347-A	A kind of synthetic method of 1- methyl-1 H- indazole -6- formic acid	20190617
US-2020352942-A1	Dosage forms and regimens for amino acid compounds	20190408
WO-2020210404-A1	Dosage forms and regimens for amino acid compounds	20190408
US-2020155563-A1	Compounds for inhibition of alpha 4 beta 7 integrin	20181030
WO-2020092383-A1	Compounds for inhibition of alpha 4 beta 7 integrin	20181030

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Related Functional Groups

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[1082041-85-7]
5-Bromo-4-fluoro-1H-indazole
[885518-50-3]
4-Amino-6-bromo-1H-indazole
[78299-75-9]
5-Benzyloxy-1H-indazole
[3176-66-7]
7-Methyl-1H-indazole
[1082041-90-4]
5-Bromo-4-chloro-1H-indazole

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GHS Hazard Statement:	H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P316, P321, P330, P405, and P501
Signal Word:	Danger

Complexity:	151
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	209.97926
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	209.97926
Rotatable Bond Count:	0
Topological Polar Surface Area:	17.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6