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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 45790100Generated: October 23, 2026

tert-Butyl (5-iodopyridin-3-yl)carbamate

t-Butyl (5-iodopyridin-3-yl)carbamate · Tert-butyl (5-iodopyridin-3-yl)carbaMate · Carbamic acid, (5-iodo-3-pyridinyl)-, 1,1-dimethylethyl ester (9CI)

https://huagongshe.com/en/chemical/45790100

tert-Butyl (5-iodopyridin-3-yl)carbamate molecular structure

Identifiers & Physical Properties

CAS No.857266-59-2
Molecular formulaC10H13IN2O2
Average molar mass320.13 g/mol
Monoisotopic mass320.00217566 g/mol
SMILESCC(C)(C)OC(=O)Nc1cncc(I)c1
InChIKeyLJDJSMUHCDSOSH-UHFFFAOYSA-N
PubChem CID45790100
EC No.888-533-2
DTXSIDDTXSID00672221

Chemical & Physical Properties

XLogP2.1
Topological polar surface area51.2
Hydrogen bond donors1
Hydrogen bond acceptors3
Rotatable bonds3
Heavy atoms15
Formal charge0
Complexity228
Storage conditions2-8°C(protect from light)
GHS pictogramGHS07
Signal wordWarning
GHS hazard statementsH302-H317
GHS precautionary statementsP280

Safety & Regulations

GHS classificationWarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Signal wordWarning
GHS pictogramGHS07
GHS hazard statementsH302-H317
GHS precautionary statementsP280