ALANINE, N-ACETYL-3-((2-IODOETHYL)THIO)-, METHYL ESTER, L-

methyl 2-acetamido-3-(2-iodoethylsulfanyl)propanoate

CAS: 78774-20-6

Molecular Formula	`C8H14INO3S`
Molecular Weight	331.17 g/mol
LogP	1.2
Topological Polar Surface Area	80.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	330.9739
Heavy Atoms	14
Complexity	201.0

Chemical Identifiers

CAS Number	78774-20-6
SMILES	`CC(=O)NC(CSCCI)C(=O)OC`
InChIKey	`NYPOMDMZXJIAEM-UHFFFAOYSA-N`

📖 Product Overview

ALANINE, N-ACETYL-3-((2-IODOETHYL)THIO)-, METHYL ESTER, L- (CAS: 78774-20-6) is a chemical compound with molecular formula C8H14INO3S and molecular weight 331.17 g/mol. Its IUPAC systematic name is methyl 2-acetamido-3-(2-iodoethylsulfanyl)propanoate. LogP 1.2 Topological Polar Surface Area 80.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 330.9739 Heavy Atoms 14 Complexity 201.0 InChI Key: NYPOMDMZXJIAEM-UHFFFAOYSA-N. SMILES: CC(=O)NC(CSCCI)C(=O)OC.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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