Methyl 3-Aminocyclobutanecarboxylate - CAS 1206970-19-5

Catalog:	BB004931
Product Name:	Methyl 3-Aminocyclobutanecarboxylate
CAS:	1206970-19-5
Synonyms:	3-amino-1-cyclobutanecarboxylic acid methyl ester; methyl 3-aminocyclobutane-1-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 3-aminocyclobutane-1-carboxylate
Description:	Methyl 3-Aminocyclobutanecarboxylate (CAS# 1206970-19-5 ) is a useful research chemical.
Molecular Weight:	129.16
Molecular Formula:	C6H11NO2
Canonical SMILES:	COC(=O)C1CC(C1)N
InChI:	InChI=1S/C6H11NO2/c1-9-6(8)4-2-5(7)3-4/h4-5H,2-3,7H2,1H3
InChI Key:	XWBSFYWZNUKOEY-UHFFFAOYSA-N
LogP:	0.59700

Publication Number	Title	Priority Date
WO-2021203025-A1	1 h-pyrazolo[4,3-g]isoquinoline and 1 h-pyrazolo[4,3-g]quinoline derivatives as alpha-1 -antitrypsin modulators for treating alpha-1 -antitrypsin deficiency (aatd)	20200403
WO-2021203028-A1	7- or 8-hydroxy-isoquinoline and 7- or 8-hydroxy-quinoline derivatives as alpha-1 -antitrypsin modulators for treating alpha-1 -antitrypsin deficiency (aatd)	20200403
US-2021230146-A1	Thyroid hormone receptor agonists and use thereof	20200113
WO-2021143706-A1	Substituted triazinones as thyroid hormone receptor agonists	20200113
US-2021188879-A1	Chemical compounds	20190513

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Complexity:	118
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	129.078978594
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	129.078978594
Rotatable Bond Count:	2
Topological Polar Surface Area:	52.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.3