ethyl N-phenylcarbamate
PubChem CID: 7591
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | 101-99-5, N-Phenylurethane, Phenylurethane, Ethyl phenylcarbamate, ETHYL N-PHENYLCARBAMATE, Phenylurethan, Ethyl carbanilate, Euphorin, Keimstop, Carbamic acid, N-phenyl-, ethyl ester, Urethane, phenyl-, Carbanilic acid, ethyl ester, Phenylethyl carbamate, Ethyl N-phenylurethan, Carbamic acid, phenyl-, ethyl ester, Ethyl N-phenylurethane, Phenylurethan(e), Urethan, phenyl-, N-(Ethoxycarbonyl)aniline, EPC (the plant regulator), Ethyl-N-phenylcarbamate, Ethanol, carbanilate, N-PHENYLETHYL CARBAMATE, N-Phenyl ethylcarbamate, HSDB 5344, UNII-TWP7W286IF, NSC 3245, EINECS 202-995-9, ethylphenylcarbamate, Ethylester kyseliny karbanilove, BRN 1942785, AI3-15353, NSC-3245, Ethyl N-phenylcarbanilate, PHENYLURETHANE [MI], TWP7W286IF, DTXSID0059243, LBKPGNUOUPTQKA-UHFFFAOYSA-, Ethyl ester of phenylcarbamic acid, N-Phenylcarbamic Acid Ethyl Ester, 4-12-00-00619 (Beilstein Handbook Reference), ETHYL N-PHENYLCARBAMATE [HSDB], Epc(the plant regulator), Ethylester kyseliny karbanilove [Czech], NPhenylurethane, ethylcarbanilate, phenyl urethane, EUPHORIN(Lewis, R.J. Sax's Dangerous Properties of Industrial Materials. 9th ed. Volumes 1-3. New York, NY: Van Nostrand Reinhold, 1996., p. 652), EUPHORIN[Lewis, R.J. Sax's Dangerous Properties of Industrial Materials. 9th ed. Volumes 1-3. New York, NY: Van Nostrand Reinhold, 1996., p. 652], KEIMSTOP(Lewis, R.J. Sax's Dangerous Properties of Industrial Materials. 9th ed. Volumes 1-3. New York, NY: Van Nostrand Reinhold, 1996., p. 652), KEIMSTOP[Lewis, R.J. Sax's Dangerous Properties of Industrial Materials. 9th ed. Volumes 1-3. New York, NY: Van Nostrand Reinhold, 1996., p. 652], Ethyl Nphenylurethan, Ethyl Nphenylurethane, MFCD00026806, URETHAN, PHENYL, URETHANE, PHENYL, N(Ethoxycarbonyl)aniline, WLN: 2OVMR, SCHEMBL264865, Phenylcarbamic acid ethyl ester, CHEMBL2235373, DTXCID3032593, NSC3245, N-phenyl carbamic acid ethyl ester, N-phenyl-carbamic acid ethyl ester, N-phenyl-carbamic acid-ethyl ester, Carbamic acid, phenyl, ethyl ester, STK369865, AKOS002937614, NCGC00342033-01, AS-63172, CS-0312803, NS00023097, P0165, E78800, AB00375764-03, Q3742461 |
|---|---|
| Ghose Rule | True |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 38.3 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | C1CCCCC1 |
| Np Classifier Class | Aminoacids |
| Deep Smiles | CCOC=O)Ncccccc6 |
| Heavy Atom Count | 12.0 |
| Classyfire Class | Benzene and substituted derivatives |
| Scaffold Graph Node Level | C1CCCCC1 |
| Classyfire Subclass | Phenylcarbamic acid esters |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 141.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | ethyl N-phenylcarbamate |
| Veber Rule | True |
| Classyfire Superclass | Benzenoids |
| Xlogp | 2.3 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C9H11NO2 |
| Scaffold Graph Node Bond Level | c1ccccc1 |
| Inchi Key | LBKPGNUOUPTQKA-UHFFFAOYSA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 3.0 |
| Synonyms | phenylurethan |
| Esol Class | Soluble |
| Functional Groups | cNC(=O)OC |
| Compound Name | ethyl N-phenylcarbamate |
| Exact Mass | 165.079 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 165.079 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 165.19 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C9H11NO2/c1-2-12-9(11)10-8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H,10,11) |
| Smiles | CCOC(=O)NC1=CC=CC=C1 |
| Np Classifier Biosynthetic Pathway | Shikimates and Phenylpropanoids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Np Classifier Superclass | Small peptides |
- 1. Outgoing r'ship
FOUND_INto/from Cupressus Torulosa (Plant) Rel Props:Reference:ISBN:9788185042053 - 2. Outgoing r'ship
FOUND_INto/from Sphaeranthus Indicus (Plant) Rel Props:Reference:ISBN:9788171360536; ISBN:9788185042053 - 3. Outgoing r'ship
FOUND_INto/from Sphaeranthus Senegalensis (Plant) Rel Props:Reference:ISBN:9788172361792