Butyl carbamate - CAS 592-35-8
Catalog: |
BB030305 |
Product Name: |
Butyl carbamate |
CAS: |
592-35-8 |
Synonyms: |
butyl carbamate |
IUPAC Name: | butyl carbamate |
Description: | Butyl carbamate (CAS# 592-35-8) is a useful research chemical. |
Molecular Weight: | 117.15 |
Molecular Formula: | C5H11NO2 |
Canonical SMILES: | CCCCOC(=O)N |
InChI: | InChI=1S/C5H11NO2/c1-2-3-4-8-5(6)7/h2-4H2,1H3,(H2,6,7) |
InChI Key: | SKKTUOZKZKCGTB-UHFFFAOYSA-N |
Boiling Point: | 204 °C |
Melting Point: | 51-56 °C |
Purity: | 95 % |
Density: | 0.99 g/cm3 |
Appearance: | White crystals |
Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
Decomposition: | When heated to decomposition it emits toxic fumes of nox |
MDL: | MFCD00007967 |
LogP: | 1.58210 |
Vapor Pressure: | 0.15 [mmHg] |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P201, P202, P261, P264, P270, P272, P280, P281, P301+P312, P302+P352, P305+P351+P338, P308+P313, P310, P321, P330, P333+P313, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
TW-202010492-A | Amino acid compounds with unbranched linkers and methods of use | 20180627 |
WO-2015190613-A1 | Radiolabeled compounds | 20140609 |
WO-2015176069-A2 | CLEARANCE OF AMYLOID ß | 20140516 |
WO-2015169784-A1 | Method for targeted conjugation of peptides and proteins by paired c2 bridging of cysteine amino acids | 20140509 |
US-2015321998-A1 | Method using zirconium catalyst for producing carbamate-functional materials | 20140508 |
PMID | Publication Date | Title | Journal |
16099654 | 20051015 | 9H-Xanthene-9-carboxylic acid [1,2,4]oxadiazol-3-yl- and (2H-tetrazol-5-yl)-amides as potent, orally available mGlu1 receptor enhancers | Bioorganic & medicinal chemistry letters |
Complexity: | 72.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 117.078978594 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 117.078978594 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 52.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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