CAS
959246-49-2 Purity
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959246-49-2 Purity
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3-N-BOC-AMINO-3-(3-CHLOROPHENYL)PROPIONIC ACID BENZYL ESTER
CAS
959246-58-3
Catalog Number
ACM959246583
Category
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Specification
Synonyms
3-N-BOC-AMINO-3-(3-CHLOROPHENYL)PROPIONIC ACID BENZYL ESTER
What is the molecular formula of the compound?
The molecular formula is C21H24ClNO4.
What are the synonyms of the compound?
The synonyms of the compound are 959246-58-3 DTXSID00697116 3-N-BOC-AMINO-3-(3-CHLOROPHENYL)PROPIONIC ACID BENZYL ESTER BENZYL 3-[(TERT-BUTOXYCARBONYL)AMINO]-3-(3-CHLOROPHENYL)PROPANOATE.
What is the molecular weight of the compound?
The molecular weight is 389.9 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is benzyl 3-(3-chlorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate.
What is the InChI of the compound?
The InChI is InChI=1S/C21H24ClNO4.
What is the InChIKey of the compound?
The InChIKey is IAXVTBRCESIBNV-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES is CC(C)(C)OC(=O)NC(CC(=O)OCC1=CC=CC=C1)C2=CC(=CC=C2)Cl.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 4.4.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts does the compound have?
The compound has 4 hydrogen bond acceptor counts.
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