CC(C)(C)OC(=O)Nn1cccc1
CAS: 937046-95-2
Nom: tert-butyl N-pyrrol-1-ylcarbamate
SMILES: CC(C)(C)OC(=O)Nn1cccc1

Molecular Processing

Molecular formula
C9H14N2O2
Molecular weight
182.22
Exact mass
182.1055
XLogP
1.97
TPSA
43.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
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
0.444
Molar refractivity
50.03

Supplementary Information

InChIKey: JDOTVVAIWOCYFL-UHFFFAOYSA-N
Synonymes
937046-95-2TERT-BUTYL 1H-PYRROL-1-YLCARBAMATEDTXSID40678242EC 810-523-3RefChem:892142DTXCID10628991810-523-3PYRROL-1-YL-CARBAMIC ACID TERT-BUTYL ESTERtert-butyl N-pyrrol-1-ylcarbamateN-(1H-PYRROL-1-YL)(TERT-BUTOXY)FORMAMIDEMFCD09863891Pyrrol-1-yl-carbamicacid tert-butyl estertert-Butyl (1H-pyrrol-1-yl)carbamate1-(Boc-amino)pyrroletert-Butyl1H-pyrrol-1-ylcarbamateSCHEMBL59469orb3144192JDOTVVAIWOCYFL-UHFFFAOYSA-NSC4442TYD-03531AKOS006314517CS-W001687MB07933AS-54675SY020948DB-079666NS00004420EN300-180266F092896
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Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→