790299-78-4
CARBAMIC ACID, (3-AMINO-4-METHYLPHENYL)-, 1,1-DIMETHYLETHYL ESTER, MONOHYDROBROMIDE
NameCARBAMIC ACID, (3-AMINO-4-METHYLPHENYL)-, 1,1-DIMETHYLETHYL ESTER, MONOHYDROBROMIDE
FormulaC12 H18 N2 O2 . Br H
1Identification
【Name】
CARBAMIC ACID, (3-AMINO-4-METHYLPHENYL)-, 1,1-DIMETHYLETHYL ESTER, MONOHYDROBROMIDE
【CAS】
【MDL】
MFCD13182477
【English Synonyms】
【Formula】
C12 H18 N2 O2 . Br H
【MolWeight】
303.198
【Inchi】
InChI=1S/C12H18N2O2.BrH/c1-8-5-6-9(7-10(8)13)14-11(15)16-12(2,3)4;/h5-7H,13H2,1-4H3,(H,14,15);1H
【InChIKey】
InChIKey=METDWMREXUSBGK-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1N)NC(=O)OC(C)(C)C.Br
【MOL File】
CARBAMIC ACID, (3-AM….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
CARBAMIC ACID, (3-AMINO-4-METHYLPHENYL)-, 1,1-DIMETHYLETHYL ESTER, MONOHYDROBROMIDE.cml