AG003DLX

41775-76-2 | 1,4,7-Trioxa-10-azacyclododecane

AG003DLX

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CAS Number	41775-76-2
Catalog Number	AG003DLX(AGN-PC-0WAJY3)
Chemical Name	1,4,7-Trioxa-10-azacyclododecane
EC Number	255-549-0
IUPAC Name	1,4,7-trioxa-10-azacyclododecane
InChI	InChI=1S/C8H17NO3/c1-3-10-5-7-12-8-6-11-4-2-9-1/h9H,1-8H2
InChI Key	QNSRHBOZQLXYNV-UHFFFAOYSA-N
MDL Number	MFCD00134269
Molecular Formula	C8H17NO3
Molecular Weight	175.2255
SMILES	O1CCOCCOCCNCC1
Synonyms	1,4,7-Trioxa-10-azacyclododecane, 41775-76-2, 1-Aza-12-crown 4-Ether, aza-12-crown-4, QNSRHBOZQLXYNV-UHFFFAOYSA-N, EINECS 255-549-0, ACMC-209spc, AC1LC0RU, 1-Aza-12-crown4-Ether, AC1Q1IC2, Oprea1_780524, SCHEMBL1176879, CTK1D8476, DTXSID10194606, HMS1607N16, ZINC242347, 1-aza-4,7,10-trioxacyclododecane, Aza-12-crown-4, 99.5+%, 1,4,7-trioxa-10-aza cyclododecane, ANW-41470, MFCD00134269, STK653263, AKOS001579676, FCH1115536, MCULE-6156517066, RTR-016466, ACM41775762, KS-000012E7, 1-Aza-12-crown-4, >=97.0%, SC-35527, 1,4,7-TRIOXA-10-AZACYCLODODECAN, TR-016466, FT-0690892, ST50307223, I14-47056, 1-Aza-12-crown-4, C8-H17-N-O3, CID545817, A1552,

Complexity	90.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	175.121g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	175.228g/mol
Monoisotopic Mass	175.121g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	39.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number