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Structure

2-Amino-3-Bocamino-benzoic acid

CAS
954238-49-4
Catalog Number
ACM954238494
Category
Other Products
Molecular Weight
252.2694
Molecular Formula
C12H16N2O4

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Specification

MDL Number
MFCD09701216
Size
50mg,100mg,250mg,500mg,1g,5g
What is the molecular formula of 2-Amino-3-bocamino-benzoic acid?

The molecular formula is C12H16N2O4.

What are the synonyms for 2-Amino-3-bocamino-benzoic acid?

The synonyms are: 2-Amino-3-bocamino-benzoic acid, 954238-49-4, 2-AMINO-3-BOCAMINO-BENZOICACID, and SCHEMBL14877164.

What is the molecular weight of 2-Amino-3-bocamino-benzoic acid?

The molecular weight is 252.27 g/mol.

What is the IUPAC name of 2-Amino-3-bocamino-benzoic acid?

The IUPAC name is 2-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid.

What is the InChI of 2-Amino-3-bocamino-benzoic acid?

The InChI is InChI=1S/C12H16N2O4/c1-12(2,3)18-11(17)14-8-6-4-5-7(9(8)13)10(15)16/h4-6H,13H2,1-3H3,(H,14,17)(H,15,16).

What is the InChIKey of 2-Amino-3-bocamino-benzoic acid?

The InChIKey is GUOZBNNNPLTHOR-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Amino-3-bocamino-benzoic acid?

The canonical SMILES is CC(C)(C)OC(=O)NC1=CC=CC(=C1N)C(=O)O.

What is the XLogP3-AA value of 2-Amino-3-bocamino-benzoic acid?

The XLogP3-AA value is 1.9.

What is the hydrogen bond donor count of 2-Amino-3-bocamino-benzoic acid?

The hydrogen bond donor count is 3.

Is 2-Amino-3-bocamino-benzoic acid a canonicalized compound?

Yes, it is a canonicalized compound.

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