AG001CDU

1404111-67-6 | 5,8,11,14-Tetraoxa-2-azahexadecanoic acid, 16-hydroxy-, 1,1-dimethylethyl ester

AG001CDU

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CAS Number	1404111-67-6
Catalog Number	AG001CDU(AGN-PC-0WQUBW)
Chemical Name	5,8,11,14-Tetraoxa-2-azahexadecanoic acid, 16-hydroxy-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl N-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]carbamate
InChI	InChI=1S/C15H31NO7/c1-15(2,3)23-14(18)16-4-6-19-8-10-21-12-13-22-11-9-20-7-5-17/h17H,4-13H2,1-3H3,(H,16,18)
InChI Key	PBWLVPPLXJCLBC-UHFFFAOYSA-N
MDL Number	MFCD27635183
Molecular Formula	C15H31NO7
Molecular Weight	337.4091
SMILES	OCCOCCOCCOCCOCCNC(OC(C)(C)C)=O
Synonyms	N-Boc-PEG5-alcohol, 1404111-67-6, tert-Butyl (14-hydroxy-3,6,9,12-tetraoxatetradecyl)carbamate, BocNH-PEG5-OH, BIPG1662, SCHEMBL18365027, BBL104084, MFCD27635183, STL557899, ZINC96503408, AKOS030629104, BP-22007, tert-butyl (14-hydroxy-3,6,9,12-tetraoxatetradec-1-yl)carbamate, 5,8,11,14-Tetraoxa-2-azahexadecanoic acid, 16-hydroxy-, 1,1-dimethylethyl ester, tert-Butyl N-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]carbamate,

Complexity	282
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	337.21g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	337.413g/mol
Monoisotopic Mass	337.21g/mol
Rotatable Bond Count	16
Topological Polar Surface Area	95.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P280-P305+P351+P338
UN Code	\N

Certificate of Analysis

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