AG00HVJF

1393330-40-9 | Acetylene-peg5-nhs ester

AG00HVJF

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CAS Number	1393330-40-9
Catalog Number	AG00HVJF(AGN-PC-0WNWPI)
Chemical Name	Acetylene-peg5-nhs ester
IUPAC Name	(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethoxy]propanoate
InChI	InChI=1S/C18H27NO9/c1-2-6-23-8-10-25-12-14-27-15-13-26-11-9-24-7-5-18(22)28-19-16(20)3-4-17(19)21/h1H,3-15H2
InChI Key	ACZDUKRWTPZVRP-UHFFFAOYSA-N
MDL Number	MFCD22574798
Molecular Formula	C18H27NO9
Molecular Weight	401.4083
SMILES	C#CCOCCOCCOCCOCCOCCC(ON1C(CCC1=O)=O)=O
Synonyms	Propargyl-PEG5-NHS ester, 1393330-40-9, Alkyne-PEG5-N-hydroxysuccinimidyl ester, 2,5-Dioxopyrrolidin-1-yl 4,7,10,13,16-pentaoxanonadec-18-yn-1-oate, Alkyne-PEG5-NHS Ester, BIPG1736, SCHEMBL17793345, MFCD22574798, AKOS030629103, ZINC100008478, BP-20907, P2283, 4,7,10,13,16-Pentaoxanonadec-18-ynoic Acid N-Succinimidyl Ester, 4,7,10,13,16-Pentaoxa-18-nonadecyneoic acid 2,5-dioxopyrrolidine-1-yl ester, Acetylene-PEG5-NHS ester, N-Succinimidyl 4,7,10,13,16-pentaoxanonadec-18-ynoate,

Complexity	512
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	401.169g/mol
Formal Charge	0
Heavy Atom Count	28
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	401.412g/mol
Monoisotopic Mass	401.169g/mol
Rotatable Bond Count	18
Topological Polar Surface Area	110A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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