tert-butyl N-[cis-3-(hydroxymethyl)cyclopentyl]carbamate - CAS 167081-31-4
Catalog: |
BB012350 |
Product Name: |
tert-butyl N-[cis-3-(hydroxymethyl)cyclopentyl]carbamate |
CAS: |
167081-31-4 |
Synonyms: |
N-[(1R,3S)-3-(hydroxymethyl)cyclopentyl]carbamic acid tert-butyl ester; tert-butyl N-[(1R,3S)-3-(hydroxymethyl)cyclopentyl]carbamate |
IUPAC Name: | tert-butyl N-[(1R,3S)-3-(hydroxymethyl)cyclopentyl]carbamate |
Description: | tert-butyl N-[cis-3-(hydroxymethyl)cyclopentyl]carbamate (CAS# 167081-31-4) is a useful research chemical. |
Molecular Weight: | 215.293 |
Molecular Formula: | C11H21NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1CCC(C1)CO |
InChI: | InChI=1S/C11H21NO3/c1-11(2,3)15-10(14)12-9-5-4-8(6-9)7-13/h8-9,13H,4-7H2,1-3H3,(H,12,14)/t8-,9+/m0/s1 |
InChI Key: | VZZBOERLWPQMCJ-DTWKUNHWSA-N |
LogP: | 0.00000 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020131154-A1 | Pyrazolyl compounds and methods of use thereof | 20181026 |
WO-2020087024-A1 | Pyrazolyl compounds and methods of use thereof | 20181026 |
CN-113226321-A | Pyrazolyl compounds and methods of use thereof | 20181026 |
EP-3870177-A1 | Pyrazolyl compounds and methods of use thereof | 20181026 |
US-11053221-B2 | Substituted pyrimidines for inhibiting embryonic leucine zipper kinase activity | 20181026 |
Complexity: | 222 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.15214353 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.15214353 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 58.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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Cyclopentane
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