4-[(tert-Butoxycarbonyl)amino]pyridine-3-boronicacid

• CAS: 863752-59-4
• Catalog Number: ACM863752594
• Category: Boro-Amino Acids
• Molecular Weight: 238.0
• Molecular Formula: C₁₀H₁₅BN₂O₄
• Synonyms: 863752-59-4, 4-(T-BUTOXYCARBONYLAMINO)PYRIDINE-3-BORONIC ACID, 4-(tert-butoxycarbonylamino)pyridin-3-ylboronic acid, AG-H-48287, (4-((tert-Butoxycarbonyl)amino)pyridin-3-yl)boronic acid, (4-[(TERT-BUTOXYCARBONYL)AMINO]PYRIDIN-3-YL)BORONIC ACID, PubChem20176, ACMC-209q9h, SureCN1233405, CTK5F6529, ANW-38307, AKOS015838207, AB54714, RL05335, AK-84354, KB-35247, X2518, 4-(BOC-AMINO)PYRIDINE-3-BORONIC ACID, B-3883, 4-(t-Butoxycarbonylamino)pyridine-3-boronic acid,
• IUPAC Name: [4-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]boronic acid
• SMILES: B(C1=C(C=CN=C1)NC(=O)OC(C)(C)C)(O)O
• InChI Key: VTWBZVDHQCJRAA-UHFFFAOYSA-N
• Exact Mass: 238.11200
• H-Bond Acceptor: 5
• H-Bond Donor: 3

Custom Q&A

What is the molecular formula of the compound?

The molecular formula is C10H15BN2O4.

What are the synonyms for the compound?

The synonyms are 863752-59-4, 4-((tert-Butoxycarbonyl)amino)pyridin-3-yl)boronic acid, and 4-(T-BUTOXYCARBONYLAMINO)PYRIDINE-3-BORONIC ACID.

What is the molecular weight of the compound?

The molecular weight is 238.05 g/mol.

When was the compound created?

The compound was created on July 26, 2010.

What is the IUPAC name of the compound?

The IUPAC name is [4-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]boronic acid.

What is the InChI of the compound?

The InChI is InChI=1S/C10H15BN2O4/c1-10(2,3)17-9(14)13-8-4-5-12-6-7(8)11(15)16/h4-6,15-16H,1-3H3,(H,12,13,14).

What is the InChIKey of the compound?

The InChIKey is VTWBZVDHQCJRAA-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is B(C1=C(C=CN=C1)NC(=O)OC(C)(C)C)(O)O.

How many hydrogen bond donor counts does the compound have?

The compound has 3 hydrogen bond donor counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.