CAS 42303-42-4 Ethyl 1-aminocyclopropane-1-carboxylate hydrochloride (HCID 386203)

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Basic information

CAS: 42303-42-4
Standard SMILES: CCOC(=O)C1(N)CC1.Cl
InChIKey: XFNUTZWASODOQK-UHFFFAOYSA-N
Molecular formula: C6H12ClNO2
Average molar mass: 165.62 g/mol
Monoisotopic mass: 165.0556563

Names & identifiers

Preferred name: Ethyl 1-aminocyclopropane-1-carboxylate hydrochloride
IUPAC: ethyl 1-aminocyclopropane-1-carboxylate;hydrochloride
English name: Ethyl 1-aminocyclopropanecarboxylate hydrochloride
Molecular formula: C6H12ClNO2
Molecular weight: 165.62

Names & synonyms

Ethyl 1-aminocyclopropanecarboxylate hydrochlorideethyl 1-aminocyclopropane-1-carboxylate hydrochlorideRefChem:593291663-219-6672-789-542303-42-41-Aminocyclopropane-1-carboxylic acid ethyl ester hydrochlorideH-Acpc-OEt.HCl1-Amino-Cyclopropyl-1-Carboxylic Acid Ethyl Ester HydrochlorideMFCD00190747ethyl 1-aminocyclopropanecarboxylate;hydrochlorideFD1022

Show more names

H-ACPC-OET hydrochlorideACPC-OEt HClACPC-OMe HClH-AC3C-OET HCLH-ACPC-OET HCLH-CAIB-OET HCLH-(1)NHCPROPN-OET HCLH-AC3C-OEt HydrochlorideH-ACPC-OET HCL USP/EP/BP

CS-W008095NSC677920EN300-7372935ethyl 1-aminocyclopropane-1-carboxylate;hydrochloride1-Aminocyclopropane-1-carboxylic acidethyl ester hydrochloride1-Aminocyclopropanecarboxylic Acid Ethyl Ester Hydrochloride1-amino-1-cyclopropanecarboxylic acid ethyl ester hydrochlorideEthyl 1-aminocyclopropanecarboxylate hydrochloride ; ACPC-OMe HCl

Database identifiers

Properties

Computed structural properties

Topological polar surface area: 52.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 10
Formal charge: 0
Complexity: 129

Physicochemical properties

Melting point: 110 and · gt. 110.0 and le 118.0 °C
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
Water Solubility: Soluble in water
form: Crystalline Powder
color: White
InChI: 1S/C6H11NO2.ClH/c1-2-9-5(8)6(7)3-4-6;/h2-4,7H2,1H3;1H
InChIKey: XFNUTZWASODOQK-UHFFFAOYSA-N
SMILES: Cl.CCOC(=O)C1(N)CC1
CAS DataBase Reference: 42303 · 42303-42-4
UNSPSC Code: 12352209 · 12352209
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302
Precautionary statements: 264 · P264-P270-P301+P312-P501
Hazard Codes: Xn
Risk Statements

Safety & regulation

GHS classification

GHS Classification · 6 items

Warning

H302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P280, P301+P317, P302+P352, P321, P330, P332+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

H315 (97.1%): Causes skin irritation [Warning Skin corrosion/irritation]