tert-Butyl N-(2-Chloroethyl)-N-methylcarbamate - CAS 220074-38-4
Catalog: |
BB070884 |
Product Name: |
tert-Butyl N-(2-Chloroethyl)-N-methylcarbamate |
CAS: |
220074-38-4 |
Synonyms: |
tert-butyl N-(2-chloroethyl)-N-methylcarbamate; tert-butyl (2-chloroethyl)(methyl)carbamate; (2-chloro-ethyl)-methyl-carbamic acid tert-butyl ester; tert-butyl 2-chloroethyl(methyl)carbamate |
IUPAC Name: | tert-butyl N-(2-chloroethyl)-N-methylcarbamate |
Molecular Weight: | 193.67 |
Molecular Formula: | C8H16NO2Cl |
Canonical SMILES: | CC(C)(C)OC(=O)N(C)CCCl |
InChI: | InChI=1S/C8H16ClNO2/c1-8(2,3)12-7(11)10(4)6-5-9/h5-6H2,1-4H3 |
InChI Key: | VQFOCOGVVYWWRJ-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P354+P338, P317, P321, P330, P332+P317, P362+P364, and P501 |
Signal Word: | Danger |
Complexity: | 154 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.0869564 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.0869564 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 29.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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