N1-Boc-5-methoxy-1,2-benzenediamine - CAS 362670-09-5
Catalog: |
BB022923 |
Product Name: |
N1-Boc-5-methoxy-1,2-benzenediamine |
CAS: |
362670-09-5 |
Synonyms: |
N-(2-amino-5-methoxyphenyl)carbamic acid tert-butyl ester; tert-butyl N-(2-amino-5-methoxyphenyl)carbamate |
IUPAC Name: | tert-butyl N-(2-amino-5-methoxyphenyl)carbamate |
Description: | N1-Boc-5-methoxy-1,2-benzenediamine (CAS# 362670-09-5) is a useful research chemical. |
Molecular Weight: | 238.28 |
Molecular Formula: | C12H18N2O3 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1=C(C=CC(=C1)OC)N |
InChI: | InChI=1S/C12H18N2O3/c1-12(2,3)17-11(15)14-10-7-8(16-4)5-6-9(10)13/h5-7H,13H2,1-4H3,(H,14,15) |
InChI Key: | ATQQUUXZLWAIMY-UHFFFAOYSA-N |
LogP: | 3.21920 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P272, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111116469-A | HDAC inhibitor, preparation method, pharmaceutical composition and application thereof | 20191227 |
AU-2003205695-A1 | Dihydro-benzo[B][1,4]diazepin-2-one derivatives | 20020206 |
CA-2474219-C | Dihydrobenzodiazepin-2-one derivatives iii | 20020206 |
DE-60316538-T2 | DIHYDROBENZODIAZEPINE-2-ON DERIVATIVE FOR THE TREATMENT OF NEUROLOGICAL ILLNESSES | 20020206 |
EP-1474416-A1 | Dihydrobenzodiazepin-2-one-derivatives for the treatment of neurological disorders | 20020206 |
Complexity: | 263 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 238.13174244 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 238.13174244 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 73.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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Amines and Anilines
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