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Home Other Building Blocks [2-(3-Amino-phenyl)-ethyl]-carbamic acid tert-butyl ester

[2-(3-Amino-phenyl)-ethyl]-carbamic acid tert-butyl ester

CAS No.:
180079-94-1
Catalog Number:
AG0021OI
Molecular Formula:
C13H20N2O2
Molecular Weight:
236.3101
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$113
- +
1g
97%
In Stock USA
United States
$282
- +
5g
97%
In Stock USA
United States
$888
- +
Product Description
Catalog Number:
AG0021OI
Chemical Name:
[2-(3-Amino-phenyl)-ethyl]-carbamic acid tert-butyl ester
CAS Number:
180079-94-1
Molecular Formula:
C13H20N2O2
Molecular Weight:
236.3101
MDL Number:
MFCD05663960
IUPAC Name:
tert-butyl N-[2-(3-aminophenyl)ethyl]carbamate
InChI:
InChI=1S/C13H20N2O2/c1-13(2,3)17-12(16)15-8-7-10-5-4-6-11(14)9-10/h4-6,9H,7-8,14H2,1-3H3,(H,15,16)
InChI Key:
LYUHXMSAHNAMFY-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCCc1cccc(c1)N
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.152g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
236.315g/mol
Monoisotopic Mass:
236.152g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties