AG00HVJB

1393330-36-3 | Bromo-PEG1-t-butyl ester

AG00HVJB

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CAS Number	1393330-36-3
Catalog Number	AG00HVJB(AGN-PC-0WR0O9)
Chemical Name	Bromo-PEG1-t-butyl ester
IUPAC Name	tert-butyl 3-(2-bromoethoxy)propanoate
InChI	InChI=1S/C9H17BrO3/c1-9(2,3)13-8(11)4-6-12-7-5-10/h4-7H2,1-3H3
InChI Key	KRGOEVTUVNSLIG-UHFFFAOYSA-N
MDL Number	MFCD22574803
Molecular Formula	C9H17BrO3
Molecular Weight	253.1335
SMILES	BrCCOCCC(=O)OC(C)(C)C
Synonyms	Bromo-PEG1-t-butyl ester, 1393330-36-3, Br-PEG1-CH2CH2COOtBu, BIPG1347, SCHEMBL15095951, ZINC83254084, tert-butyl 3-(2-bromoethoxy)propanoate, BP-20900,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	252.036g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	253.136g/mol
Monoisotopic Mass	252.036g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P313-P337+P313-P362-P403+P233-P405-P501
UN Code	\N

Certificate of Analysis

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