CC(C)(C)OC(=O)NCCC1=CC=C(C=C1)N
CAS: 94838-59-2
Name: tert-butyl N-[2-(4-aminophenyl)ethyl]carbamate
SMILES: CC(C)(C)OC(=O)NCCC1=CC=C(C=C1)N

Molecular Processing

Molecular formula
C13H20N2O2
Molecular weight
236.31
Exact mass
236.1525
XLogP
2.34
TPSA
64.35
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
68.8

Supplementary Information

InChIKey: HOPALBZGTWDOTL-UHFFFAOYSA-N
Synonyme
tert-butyl 4-aminophenethylcarbamateDTXSID20327605RefChem:1099557DTXCID9027871694838-59-24-[2-(BOC-AMINO)ETHYL]ANILINE[2-(4-Amino-phenyl)-ethyl]-carbamic acid tert-butyl estertert-butyl N-[2-(4-aminophenyl)ethyl]carbamateMFCD05663961N-Boc-4-aminophenethylamine[2-(4-Aminophenyl)ethyl]carbamic acid tert-butyl estertert-butyl [2-(4-aminophenyl)ethyl]carbamateNSC669666Carbamic acid, [2-(4-aminophenyl)ethyl]-, 1,1-dimethylethyl ester (9CI); N-tert-Butoxycarbonyl-2-(4-aminophenyl)ethylamine; N-tert-Butoxycarbonyl-4-aminophenethylamine; [2-(4-Aminophenyl)ethyl]carbamic acid tert-butyl ester; tert-Butyl (2-(4-Aminophenyl)ethyl)carbamate; tert-Butyl 4-aminophenethylcarbamatetert-butyl (4-aminophenethyl)carbamateSCHEMBL448114SCHEMBL78789724-(N-Boc-2-aminoethyl)anilineCHEMBL2008649Tert-butyl 2-(4-aminophenyl)ethylcarbamate hydrochlorideHOPALBZGTWDOTL-UHFFFAOYSA-Ntert-butyl4-aminophenethylcarbamateAKOS010469462AB22067CS-W003234t-butyl 2-(4-aminophenyl)ethylcarbamateAC-29368NCI60_024327NS-03200SY021926
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