cis-3-(Boc-amino)cyclobutanol - CAS 389890-43-1

Catalog:	BB023817
Product Name:	cis-3-(Boc-amino)cyclobutanol
CAS:	389890-43-1
Synonyms:	N-(3-hydroxycyclobutyl)carbamic acid tert-butyl ester; tert-butyl N-(3-hydroxycyclobutyl)carbamate

Technical Data

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Computed Properties

IUPAC Name:	tert-butyl N-(3-hydroxycyclobutyl)carbamate
Description:	cis-3-(Boc-amino)cyclobutanol (CAS# 389890-43-1) is a useful research chemical compound.
Molecular Weight:	187.24
Molecular Formula:	C9H17NO3
Canonical SMILES:	CC(C)(C)OC(=O)NC1CC(C1)O
InChI:	InChI=1S/C9H17NO3/c1-9(2,3)13-8(12)10-6-4-7(11)5-6/h6-7,11H,4-5H2,1-3H3,(H,10,12)
InChI Key:	WSUMHFNEPOYLJM-UHFFFAOYSA-N
Boiling Point:	303.672 °C at 760 mmHg
Density:	1.107 g/cm³
LogP:	1.42530

Publication Number	Title	Priority Date
CN-111253370-A	N-polysubstituted pyridine-2-aminopyrimidine derivatives and application thereof	20200324
CN-111253370-B	N-polysubstituted pyridine-2-aminopyrimidine derivatives and application thereof	20200324
US-2021230146-A1	Thyroid hormone receptor agonists and use thereof	20200113
WO-2021143706-A1	Substituted triazinones as thyroid hormone receptor agonists	20200113
CN-113045575-A	Preparation method of compound, intermediate thereof and preparation method of intermediate	20191227

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P312, P330, and P501
Signal Word:	Warning

Complexity:	192
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	187.12084340
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	187.12084340
Rotatable Bond Count:	3
Topological Polar Surface Area:	58.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9