2-Benzyl-4-(chloromethyl)-1,3-oxazole

HCID 22009602
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Basic information

CAS
202594-64-7
Standard SMILES
ClCc1coc(Cc2ccccc2)n1
InChIKey
CNBVZKFQJIVMFF-UHFFFAOYSA-N
Molecular formula
C11H10ClNO
Average molar mass
207.65 g/mol
Monoisotopic mass
207.0450916

Names & identifiers

Preferred name
2-Benzyl-4-(chloromethyl)-1,3-oxazole
IUPAC
2-benzyl-4-(chloromethyl)-1,3-oxazole

Names & synonyms

2-benzyl-4-(chloromethyl)-1,3-oxazole202594-64-7RefChem:465654834-129-62-benzyl-4-chloromethyloxazoleSCHEMBL57593112-benzyl-4-chloromethyl oxazole2-Benzyl-4-(chloromethyl)oxazoleCNBVZKFQJIVMFF-UHFFFAOYSA-NEN300-6736837

Database identifiers

CAS
202594-64-7
PubChem CID
22009602
EC Number
834-129-6

Properties

Computed structural propertiesFilling in

XLogP
2.7
Topological polar surface area
26 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
14

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

Related reactions

2 records
New reaction record

Compound notes

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