4-[(Boc-amino)methyl]aniline Hydrochloride - CAS 174959-54-7
Catalog: |
BB013064 |
Product Name: |
4-[(Boc-amino)methyl]aniline Hydrochloride |
CAS: |
174959-54-7 |
Synonyms: |
N-[(4-aminophenyl)methyl]carbamic acid tert-butyl ester;hydrochloride; tert-butyl N-[(4-aminophenyl)methyl]carbamate;hydrochloride |
IUPAC Name: | tert-butyl N-[(4-aminophenyl)methyl]carbamate;hydrochloride |
Description: | 4-[(Boc-amino)methyl]aniline Hydrochloride (CAS# 174959-54-7) is the hydrochloride salt of tert-Butyl(4-aminobenzyl)carbamate, an additive in carbon nanotubes. |
Molecular Weight: | 258.74 |
Molecular Formula: | C12H19ClN2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NCC1=CC=C(C=C1)N.Cl |
InChI: | InChI=1S/C12H18N2O2.ClH/c1-12(2,3)16-11(15)14-8-9-4-6-10(13)7-5-9;/h4-7H,8,13H2,1-3H3,(H,14,15);1H |
InChI Key: | UULGYZXPISSQLH-UHFFFAOYSA-N |
LogP: | 3.88110 |
Publication Number | Title | Priority Date |
AU-733621-B2 | Novel compounds and compositions for treating diseases associated with tryptase activity | 19960730 |
CA-2262542-A1 | Novel compounds and compositions for treating diseases associated with tryptase activity | 19960730 |
CZ-29799-A3 | A disubstituted cyclic compound, a process for its preparation, a pharmaceutical composition and a method of treating an animal's disease | 19960730 |
EP-0934293-A1 | Novel compounds and compositions for treating diseases associated with tryptase activity | 19960730 |
HU-0003267-A2 | Heteroaryl derivatives, pharmaceutical compositions containing these compounds and a process for their preparation | 19960730 |
Complexity: | 228 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 258.1135055 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 258.1135055 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 64.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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