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Specification
The PubChem CID of (3-Hydroxymethyl-benzyl)-carbamic acid tert-butyl ester is 2794814.
The molecular formula of (3-Hydroxymethyl-benzyl)-carbamic acid tert-butyl ester is C13H19NO3.
The molecular weight of (3-Hydroxymethyl-benzyl)-carbamic acid tert-butyl ester is 237.29 g/mol.
The IUPAC name of (3-Hydroxymethyl-benzyl)-carbamic acid tert-butyl ester is tert-butyl N-[[3-(hydroxymethyl)phenyl]methyl]carbamate.
The InChI of (3-Hydroxymethyl-benzyl)-carbamic acid tert-butyl ester is InChI=1S/C13H19NO3/c1-13(2,3)17-12(16)14-8-10-5-4-6-11(7-10)9-15/h4-7,15H,8-9H2,1-3H3,(H,14,16).
The InChIKey of (3-Hydroxymethyl-benzyl)-carbamic acid tert-butyl ester is QNDFFICIIGQGDV-UHFFFAOYSA-N.
The canonical SMILES of (3-Hydroxymethyl-benzyl)-carbamic acid tert-butyl ester is CC(C)(C)OC(=O)NCC1=CC(=CC=C1)CO.
The CAS number of (3-Hydroxymethyl-benzyl)-carbamic acid tert-butyl ester is 226070-69-5.
The European Community (EC) Number of (3-Hydroxymethyl-benzyl)-carbamic acid tert-butyl ester is 688-442-6.
Yes, (3-Hydroxymethyl-benzyl)-carbamic acid tert-butyl ester is a canonicalized compound.