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tert-Butyl ((5-(aminomethyl)thiazol-2-yl)methyl)carbamate

HCID 83671480
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Basic information

CAS
1782626-77-0
Standard SMILES
CC(C)(C)OC(=O)NCc1ncc(CN)s1
InChIKey
NCZPSSNSLKZYNB-UHFFFAOYSA-N
Molecular formula
C10H17N3O2S
Average molar mass
243.33 g/mol
Monoisotopic mass
243.10414797

Names & identifiers

Preferred name
tert-Butyl ((5-(aminomethyl)thiazol-2-yl)methyl)carbamate
IUPAC
tert-butyl N-[[5-(aminomethyl)-1,3-thiazol-2-yl]methyl]carbamate

Names & synonyms

1782626-77-0tert-Butyl ((5-(aminomethyl)thiazol-2-yl)methyl)carbamatetert-butyl N-{[5-(aminomethyl)-1,3-thiazol-2-yl]methyl}carbamateSCHEMBL24645671MFCD32757292SY4982191-[5-(Aminomethyl)thiazol-2-yl]-N-Boc-methanamine

Database identifiers

CAS
1782626-77-0
PubChem CID
83671480
EC Number
176-853-9

Properties

Computed structural properties

XLogP
0.4
Topological polar surface area
105 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
16
Formal charge
0
Complexity
243

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Related reactions

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Compound notes

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