CAS
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(3-Hydroxy-1-methyl-propyl)-carbamic acid tert-butyl ester
Catalog Number
ACMA00002819
Category
Ethers
Molecular Weight
189.25
Molecular Formula
C9H16N2O5
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Specification
Hazard Statements
H318
RIDADR
UN 3334
Symbol
GHS05
What is the molecular formula of (3-Hydroxy-1-methyl-propyl)-carbamic acid tert-butyl ester?
The molecular formula is C9H19NO3.
What is the molecular weight of (3-Hydroxy-1-methyl-propyl)-carbamic acid tert-butyl ester?
The molecular weight is 189.25 g/mol.
What is the IUPAC name of (3-Hydroxy-1-methyl-propyl)-carbamic acid tert-butyl ester?
The IUPAC name is tert-butyl N-(4-hydroxybutan-2-yl)carbamate.
What is the InChI of (3-Hydroxy-1-methyl-propyl)-carbamic acid tert-butyl ester?
The InChI is InChI=1S/C9H19NO3/c1-7(5-6-11)10-8(12)13-9(2,3)4/h7,11H,5-6H2,1-4H3,(H,10,12).
What is the InChIKey of (3-Hydroxy-1-methyl-propyl)-carbamic acid tert-butyl ester?
The InChIKey is JSZOAOLSEKSNTD-UHFFFAOYSA-N.
What is the canonical SMILES of (3-Hydroxy-1-methyl-propyl)-carbamic acid tert-butyl ester?
The canonical SMILES is CC(CCO)NC(=O)OC(C)(C)C.
What is the CAS number of (3-Hydroxy-1-methyl-propyl)-carbamic acid tert-butyl ester?
The CAS number is 146514-31-0.
What is the XLogP3-AA of (3-Hydroxy-1-methyl-propyl)-carbamic acid tert-butyl ester?
The XLogP3-AA is 1.
How many hydrogen bond donor counts does (3-Hydroxy-1-methyl-propyl)-carbamic acid tert-butyl ester have?
It has 2 hydrogen bond donor counts.
How many rotatable bond counts does (3-Hydroxy-1-methyl-propyl)-carbamic acid tert-butyl ester have?
It has 5 rotatable bond counts.
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