2- (1-Cyclopropylethoxy) acetic acid

CAT: 0127-OR1059630-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1059630-01Size:100 mg

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CAS Number

189956-03-4

MDL Number

MFCD19228904

Purity

98%

Smiles

O=C(O)COC(C1CC1)C

Chemical Information

2-(1-cyclopropylethoxy)Acetic acid

CAS Number	189956-03-4
PubChem CID	22114235
IUPAC Name	2-(1-cyclopropylethoxy)acetic acid
Molecular Formula	C7H12O3
Molecular Weight	144.17
XLogP	0.9
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	10
Formal Charge	0
Complexity	129

SMILES

CC(C1CC1)OCC(=O)O

InChI

InChI=1S/C7H12O3/c1-5(6-2-3-6)10-4-7(8)9/h5-6H,2-4H2,1H3,(H,8,9)

InChIKey

SOQVBDSJEUFZMY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 189956-03-4

CID: 22114235

Formula: C7H12O3

MW: 144.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	144.17
XLogP3	0.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	144.078644241
Monoisotopic Mass	144.078644241
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	129
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1097555-01	2-bromo-6- (1-cyclopropylethoxy) pyridine
OR1097549-01	5-bromo-2- (1-cyclopropylethoxy) pyrimidine
OR1097553-01	5-bromo-2- (1-cyclopropylethoxy) pyridine
OR1074712-01	2- (1-Hydroxycyclohexyl) acetic acid
OR1067298-01	2- (1-Cyanocyclopropyl) acetic acid
OR315160-01	1-Methylpyrrole-2-acetic acid
OR1045511-01	2- (1-Cyanocyclohexyl) acetic acid
OR1028866-01	2- (1-Pyrrolidyl) Acetic Acid
OR87334-01	2- (1-Hydroxycyclobutyl) acetic acid
OR89200	2- (1-Methoxycyclopropyl) acetic acid

Catalog	Name
AA10	Acetic Acid solution 1 % (Acetic acid solution)
40100317-3	Acetic Acid 1%
40140017-1	Acid Fuchsin (1%) in 1% Acetic Acid
TRC-A145030-500MG	Acetic acid-1-13C
GK4917-100g	Naphthalene-1-acetic acid
TRC-H954453-50MG	(1-Hydroxycyclohexyl)acetic Acid
sc-303145	(1-Aminocyclohexyl) acetic acid
RRSP171-F	Acetic Acid 1% Solution
FA07663	1-Adamantane acetic acid
AAE500	Acetic Acid Solution (1%)