Compound: urethane
SMILES: O=C(OCC)N
InChIKey: JOYRKODLDBILNP-UHFFFAOYSA-N
Synonyms: urethane, ETHYL CARBAMATE, 51-79-6, Carbamic acid, ethyl ester, Leucethane, Pracarbamine, Carbamic acid ethyl ester, Ethylurethane, Ethyl urethane, Ethylcarbamate, O-Ethylurethane, Pracarbamin, Ethyl urethan, Leucothane, U-Compound, Aethylcarbamat, Aethylurethan, Ethylurethan, Estane 5703, ethyl aminoformate, Uretan, Uretan etylowy, Uretano, NSC 746, Carbamidsaeure-aethylester, Urethanum, Ethyl ester of carbamic acid, Ethylester kyseliny karbaminove, Carbamate, Ethyl, Urethanum [INN-Latin], NSC-746, DTXSID9021427, A 11032, NSC746, 3IN71E75Z5, DTXCID301427, CHEBI:17967, Urethanum (INN-Latin), RefChem:193263, 200-123-1, Urethan, Uretano [DCIT], Aethylurethan [German], Aethylcarbamat [German], O-Ethyl urethane, MFCD00007966, RCRA waste number U238, X 41, NH2COOC2H5, Aethylurethan (german), NCGC00095041-01, Aethylcarbamat (german), Uretan etylowy [Polish], Ethyl carbamate;Carbamic acid ethyl ester;Ethylurethane, Carbamidsaeure-aethylester [German], o-Ethyl carbamate, CAS-51-79-6, Urethane [INN:BAN:DCF], CCRIS 619, Ethylester kyseliny karbaminove [Czech], HSDB 2555, Urethane [INN:DCF], SR-05000001854, EINECS 200-123-1, RCRA waste no. U238, ethyl-carbamate, UNII-3IN71E75Z5, AI3-00553, Urethane, INN, Urethane (Standard), Spectrum_001685, Urethane, >=99%, URETHANE [HSDB], URETHANE [INN], URETHAN [MI], Spectrum2_000909, Spectrum3_000965, Spectrum4_001082, Spectrum5_001651, URETHANE [WHO-DD], WLN: ZVO2, SCHEMBL8136, SCHEMBL23851, BSPBio_002569, KBioGR_001464, KBioSS_002165, Urethane, analytical standard, BIDD:ER0508, DivK1c_000060, SCHEMBL208275, SCHEMBL208276, SPECTRUM1503304, SPBio_000758, ETHYL CARBAMATE [IARC], CHEMBL462547, orb1310989, orb3140239, SCHEMBL3649413, SCHEMBL6356181, HMS500C22, HY-B1207R, KBio1_000060, KBio2_002165, KBio2_004733, KBio2_007301, KBio3_001789, MSK7901, Urethane + ethanol (combination), NINDS_000060, Urethane, >=99.0% (GC), HMS1922A10, HMS2093C21, HMS3885F08, HMS5083L09, Pharmakon1600-01503304, HY-B1207, YCA96207, Tox21_111398, Tox21_201761, Tox21_300494, CCG-39905, EBC-17024, HB6627, NSC758452, s4544, STL257390, AKOS000118772, Tox21_111398_1, CS-4731, DB04827, FU28644, NSC-758452, IDI1_000060, NCGC00095041-02, NCGC00095041-03, NCGC00095041-04, NCGC00095041-05, NCGC00095041-06, NCGC00095041-08, NCGC00254522-01, NCGC00259310-01, SBI-0051812.P002, SBI-0051812.P003, DB-052027, NS00020313, EN300-15607, C01537, F21294, AB00052344_04, F787609, Q422884, SR-05000001854-1, SR-05000001854-2, BRD-K24297741-001-01-1, BRD-K24297741-001-05-2, Z33546369, F0001-1333, InChI=1/C3H7NO2/c1-2-6-3(4)5/h2H2,1H3,(H2,4,5
Theoretical properties:
molecular_formula: C3H7NO2
molecular_weight: 89.09 g/mol
exact_mass: 89.047678466 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 2
heavy_atom_count: 6
topological_polar_surface_area: 52.3 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: Colorless, columnar crystals or white, granular powder
color: Colorless, columnar crystals or white, granular powder
odor: Almost odorless
boiling_point: 360 to 363 °F at 760 mmHg (NTP, 1992)
melting_point: 118 to 122 °F (NTP, 1992)
density: 0.9862 at 70 °F (NTP, 1992) - Less dense than water; will float
solubility: greater than or equal to 100 mg/mL at 72 °F (NTP, 1992)
flash_point: 198 °F (NTP, 1992)
vapor_pressure: 5 mmHg at 150.4 °F ; 10 mmHg at 172.0 °F; 20 mmHg at 195.8 °F (NTP, 1992)
Descriptions:
pubchem: Urethane (Ethyl Carbamate) can cause cancer according to an independent committee of scientific and health experts. It can cause developmental toxicity according to The Environmental Protection Agency (EPA).
chebi: A carbamate ester obtained by the formal condensation of ethanol with carbamic acid. It has been found in alcoholic beverages.
chembl: URETHANE is a small molecule listed in the ChEMBL database and has reached clinical trial phase 4.0.
wikipedia: Urethane may refer to:

Ethyl carbamate, a chemical compound which is an ester of carbamic acid
Polyurethane, a polymer composed of a chain of organic units joined by carbamate (urethane) links
Carbamate, an organic compound derived from carbamic acid