Ethyl 3-cyclopropylacrylate - CAS 5808-99-1

Catalog:	BB029925
Product Name:	Ethyl 3-cyclopropylacrylate
CAS:	5808-99-1
Synonyms:	ethyl 3-cyclopropylprop-2-enoate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	ethyl 3-cyclopropylprop-2-enoate
Description:	Ethyl 3-cyclopropylacrylate (CAS# 5808-99-1) is used as a reactant for the preparation of quinolizinone- and pyridopyrimidinonecarboxylates as antibacterials. This compound is also used in the preparation of Carbomoylcholine analogs.
Molecular Weight:	140.18
Molecular Formula:	C8H12O2
Canonical SMILES:	CCOC(=O)C=CC1CC1
InChI:	InChI=1S/C8H12O2/c1-2-10-8(9)6-5-7-3-4-7/h5-7H,2-4H2,1H3
InChI Key:	HXBCPBSHJYHXQV-UHFFFAOYSA-N
LogP:	1.51570

Publication Number	Title	Priority Date
US-2017044146-A1	Gpr40 agonists for the treatment of type ii diabetes	20150812
US-2017044147-A1	Gpr40 agonists for the treatment of type ii diabetes	20150812
US-2017044148-A1	Gpr40 agonists for the treatment of type ii diabetes	20150812
US-9856245-B2	GPR40 agonists for the treatment of type II diabetes	20150812
US-9908873-B2	GPR40 agonists for the treatment of type II diabetes	20150812

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Related Functional Groups

Oxygen Compounds

[544-62-7]
Batyl alcohol
[1427004-19-0]
DBCO-PEG4-NHS ester
[5896-75-3]
(Z)-N-(4-Phenylpiperazin-1-yl)-1-(2,3,4-trimethoxyphenyl)methanimine
[1263034-11-2]
[(2-Azido-3-hexadecoxypropoxy)-diphenylmethyl]benzene
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	145
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	140.083729621
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	140.083729621
Rotatable Bond Count:	4
Topological Polar Surface Area:	26.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	1
XLogP3:	1.9