CAS
98395-76-7 Purity
96%
98395-76-7 Purity
96%
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4-(Boc-amino)pyridine
CAS
98400-69-2
Catalog Number
ACM98400692
Category
Other Products
Molecular Weight
194.23
Molecular Formula
C10H14N2O2
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Specification
Synonyms
4-(Boc-amino)pyridine, 4-(tert-butoxycarbonylamino)pyridine, 98400-69-2, tert-butyl pyridin-4-ylcarbamate, tert-Butyl N-(4-Pyridyl)carbamate, tert-butyl N-(pyridin-4-yl)carbamate, ST50825371, PubChem20060, ACMC-209sa9, SureCN334709, KSC495M3F, 658707_ALDRICH, N-BOC-4-AMINO-PYRIDINE, CTK3J5632, MolPort-003-938-454, ANW-40927, ZINC12478475, AKOS009462060, AB11054, AG-B-09192
IUPAC Name
tert-butyl N-pyridin-4-ylcarbamate
SMILES
CC(C)(C)OC(=O)NC1=CC=NC=C1
InChI Key
DRZYCRFOGWMEES-UHFFFAOYSA-N
Boiling Point
252.7ºC at 760mmHg
Melting Point
145-149ºC
Flash Point
106.7ºC
Density
1.131g/cm³
Exact Mass
194.10600
Hazard Statements
Xn:Harmful;
H-Bond Acceptor
3
H-Bond Donor
1
Safety Description
S36/37
What is the IUPAC name of the compound?
The IUPAC name of the compound is tert-butyl N-pyridin-4-ylcarbamate.
What is the molecular formula of the compound?
The molecular formula of the compound is C10H14N2O2.
What is the molecular weight of the compound?
The molecular weight of the compound is 194.23 g/mol.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C10H14N2O2/c1-10(2,3)14-9(13)12-8-4-6-11-7-5-8/h4-7H,1-3H3,(H,11,12,13).
What is the InChIKey of the compound?
The InChIKey of the compound is DRZYCRFOGWMEES-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is CC(C)(C)OC(=O)NC1=CC=NC=C1.
What is the CAS number of the compound?
The CAS number of the compound is 98400-69-2.
What is the European Community (EC) number of the compound?
The European Community (EC) number of the compound is 628-172-8.
What is the DSSTox Substance ID of the compound?
The DSSTox Substance ID of the compound is DTXSID20433755.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 51.2 ?2.
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