AG00D81V

4432-44-4 | 2-(Morpholinomethyl)acrylic acid

AG00D81V

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CAS Number	4432-44-4
Catalog Number	AG00D81V(AGN-PC-0RSO36)
Chemical Name	2-(Morpholinomethyl)acrylic acid
IUPAC Name	2-(morpholin-4-ylmethyl)prop-2-enoic acid
InChI	InChI=1S/C8H13NO3/c1-7(8(10)11)6-9-2-4-12-5-3-9/h1-6H2,(H,10,11)
InChI Key	IGZSSKAOSOCVPH-UHFFFAOYSA-N
MDL Number	MFCD06208438
Molecular Formula	C8H13NO3
Molecular Weight	171.1937
SMILES	C=C(CN1CCOCC1)C(O)=O
Synonyms	2-(Morpholinomethyl)acrylic acid, 4432-44-4, 2-MORPHOLIN-4-YLMETHYL-ACRYLIC ACID, 2-morpholin-4-ylmethyl-2-propenoic acid, 2-(morpholin-4-ylmethyl)prop-2-enoic Acid, SCHEMBL793684, CTK4I8112, DTXSID30439182, IGZSSKAOSOCVPH-UHFFFAOYSA-N, 2-(Morpholinomethyl)propenoic acid, 2-Morpholin4-ylmethyl-acrylic acid, 4868AH, AB1552, MFCD06208438, ZINC38760485, AKOS010054622, MCULE-2720405682, 2-morpholin-4ylmethyl-2-propenoic acid, 4-Morpholinepropanoicacid, a-methylene-, AJ-96850, 2-(4-morpholinylmethyl)-2-propenoic acid, AB0085720, DB-070534, FT-0718529, 2-[(morpholin-4-yl)methyl]prop-2-enoic acid, K-8942, A826542, F9995-2550, C8H13NO3, CM-414, CID10397232,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.09g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	171.196g/mol
Monoisotopic Mass	171.09g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	49.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301
Packing Group	Ⅲ
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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