(1-Isopropylpyrrolidin-3-yl)methanol - CAS 2148-53-0

Catalog:	BB016905
Product Name:	(1-Isopropylpyrrolidin-3-yl)methanol
CAS:	2148-53-0
Synonyms:	(1-propan-2-ylpyrrolidin-3-yl)methanol

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(1-propan-2-ylpyrrolidin-3-yl)methanol
Description:	(1-Isopropylpyrrolidin-3-yl)methanol (CAS# 2148-53-0) is a useful research chemical.
Molecular Weight:	143.23
Molecular Formula:	C8H17NO
Canonical SMILES:	CC(C)N1CCC(C1)CO
InChI:	InChI=1S/C8H17NO/c1-7(2)9-4-3-8(5-9)6-10/h7-8,10H,3-6H2,1-2H3
InChI Key:	AAHDGWGNYJVYMG-UHFFFAOYSA-N
Boiling Point:	181.1 °C at 760 mmHg
Density:	0.951 g/cm³
MDL:	MFCD08361791
LogP:	0.64690

Publication Number	Title	Priority Date
WO-2021127039-A1	Combinations	20191220
WO-2021127045-A1	Combinations	20191220
EP-3616753-A1	Compounds for modulating adenosine a2b receptor and adenosine a2a receptor	20180831
WO-2019157065-A1	Inhibitors of the notch transcriptional activation complex kinase ("nack") and methods for use of the same	20180206
WO-2019157065-A9	Inhibitors of the notch transcriptional activation complex kinase ("nack") and methods for use of the same	20180206

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Related Functional Groups

Pyrrolidines

[1427004-19-0]
DBCO-PEG4-NHS ester
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid
[1353995-46-6]
(R)-1-((2,4-Dichlorophenyl)sulfonyl)pyrrolidin-3-ol
[5747-92-2]
Ethyl 1-benzyl-pyrrolidine-3-carboxylate
[198959-37-4]
Methyl pyrrolidine-3-carboxylate hydrochloride
[1203499-44-8]
N-(2-Chloro-6-((3-(hydroxymethyl)pyrrolidin-1-yl)methyl)pyridin-3-yl)pivalamide

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement:	P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501
Signal Word:	Danger

Complexity:	103
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	143.131014166
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	143.131014166
Rotatable Bond Count:	2
Topological Polar Surface Area:	23.5
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8