N-Boc-4-(bromomethyl)-2,2-dimethyloxazolidine - CAS 1192488-15-5

Catalog:	BB004443
Product Name:	N-Boc-4-(bromomethyl)-2,2-dimethyloxazolidine
CAS:	1192488-15-5
Synonyms:	4-(bromomethyl)-2,2-dimethyl-3-oxazolidinecarboxylic acid tert-butyl ester; tert-butyl 4-(bromomethyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	tert-butyl 4-(bromomethyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
Description:	N-Boc-4-(bromomethyl)-2,2-dimethyloxazolidine (CAS# 1192488-15-5) is a useful research chemical.
Molecular Weight:	294.19
Molecular Formula:	C11H20BrNO3
Canonical SMILES:	CC1(N(C(CO1)CBr)C(=O)OC(C)(C)C)C
InChI:	InChI=1S/C11H20BrNO3/c1-10(2,3)16-9(14)13-8(6-12)7-15-11(13,4)5/h8H,6-7H2,1-5H3
InChI Key:	UTFPBVQWEAFHRD-UHFFFAOYSA-N
MDL:	MFCD11041413
LogP:	2.69120

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Related Functional Groups

Oxazole/Thiazole

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	273
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	293.06266
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	293.06266
Rotatable Bond Count:	3
Topological Polar Surface Area:	38.8 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3