1-Amino-3-benzyloxy-2-propanol - CAS 90503-15-4
Catalog: |
BB039872 |
Product Name: |
1-Amino-3-benzyloxy-2-propanol |
CAS: |
90503-15-4 |
Synonyms: |
1-amino-3-phenylmethoxy-2-propanol; 1-amino-3-phenylmethoxypropan-2-ol |
IUPAC Name: | 1-amino-3-phenylmethoxypropan-2-ol |
Description: | 1-Amino-3-benzyloxy-propan-2-ol can be used for its aldose reductase-inhibiting activity to treat diseases caused by insulin resistance. |
Molecular Weight: | 181.23 |
Molecular Formula: | C10H15NO2 |
Canonical SMILES: | C1=CC=C(C=C1)COCC(CN)O |
InChI: | InChI=1S/C10H15NO2/c11-6-10(12)8-13-7-9-4-2-1-3-5-9/h1-5,10,12H,6-8,11H2 |
InChI Key: | ZGHLNQMMKJNJIH-UHFFFAOYSA-N |
Boiling Point: | 331.9 ℃ at 760 mmHg |
Density: | 1.11 g/cm3 |
Appearance: | White powder |
MDL: | MFCD00183222 |
LogP: | 1.22310 |
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, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021113492-A1 | Cyclic compounds and methods of using same | 20191206 |
WO-2021077010-A1 | Bifunctional molecules containing an e3 ubiquitine ligase binding moiety linked to a bcl6 targeting moiety | 20191017 |
US-10399957-B2 | TLR7/8 antagonists and uses thereof | 20151217 |
US-10544122-B2 | TLR7/8 antagonists and uses thereof | 20151217 |
US-10696649-B2 | TLR7/8 antagonists and uses thereof | 20151217 |
Complexity: | 124 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 181.110278721 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 181.110278721 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 55.5 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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