Spiro[2.3]hexane-1-carboxylic Acid - CAS 17202-56-1

Name: Spiro[2.3]hexane-1-carboxylic Acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB012788
Product Name:	Spiro[2.3]hexane-1-carboxylic Acid
CAS:	17202-56-1
Synonyms:	2-spiro[2.3]hexanecarboxylic acid; spiro[2.3]hexane-2-carboxylic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	spiro[2.3]hexane-2-carboxylic acid
Description:	Spiro[2.3]hexane-1-carboxylic Acid (CAS# 17202-56-1) is a useful research chemical.
Molecular Weight:	126.15
Molecular Formula:	C7H10O2
Canonical SMILES:	C1CC2(C1)CC2C(=O)O
InChI:	InChI=1S/C7H10O2/c8-6(9)5-4-7(5)2-1-3-7/h5H,1-4H2,(H,8,9)
InChI Key:	VVSCGNLRDCLHAN-UHFFFAOYSA-N
Boiling Point:	239.9 °C at 760 mmHg
Density:	1.22 g/cm³
LogP:	1.26120

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]C9H8O2
Oxiran-2-yl(phenyl)methanone
[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]C8H10ClNO
(4-Pyridyl)acetone Hydrochloride
[832741-29-4]C9H11BrOS
1-(4-Bromo-5-propylthiophen-2-yl)ethanone

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P261, P264, P271, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P363, P403+P233, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
JP-2018076368-A	Combination of hepatitis C virus inhibitors	20180111
WO-2019051396-A1	SMALL MOLECULE INHIBITORS OF EBOLA VIRUSES AND LASSA FEVER, AND METHODS OF USE THEREOF	20170908
US-2021163454-A1	Small molecule inhibitors of ebola and lassa fever viruses and methods of use	20170908
AU-2018300043-A1	Bicyclic ketone compounds and methods of use thereof	20170714
CA-3067944-A1	Bicyclic ketone compounds and methods of use thereof	20170714

Complexity:	158
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	126.068079557
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	126.068079557
Rotatable Bond Count:	1
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4