AG008SMF

104530-79-2 | (S)-3-Aminotetrahydrofuran

AG008SMF

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CAS Number	104530-79-2
Catalog Number	AG008SMF(AGN-PC-0OTHOH)
Chemical Name	(S)-3-Aminotetrahydrofuran
IUPAC Name	(3S)-oxolan-3-amine
InChI	InChI=1S/C4H9NO/c5-4-1-2-6-3-4/h4H,1-3,5H2/t4-/m0/s1
InChI Key	MIPHRQMEIYLZFZ-BYPYZUCNSA-N
MDL Number	MFCD08234425
Molecular Formula	C4H9NO
Molecular Weight	87.1204
SMILES	N[C@@H]1COCC1
Synonyms	(S)-3-Aminotetrahydrofuran, 104530-79-2, (S)-tetrahydrofuran-3-amine, (3S)-OXOLAN-3-AMINE, 3-Furanamine,tetrahydro-, (3S)-, (S)-(-)-3-Aminotetrahydrofuran p-toluenesulfonate salt, 97%, Tetrahydrofuran-3beta-amine, (S)-3-amino-tetrahydrofuran, (5)-tetrahydrofuran-3-amine, (3S)-tetrahydro-3-furanamine, (3S)-tetrahydrofuran-3-amine, CTK4A3103, MIPHRQMEIYLZFZ-BYPYZUCNSA-N, ACT06806, KS-000002UD, ZINC6293198, ANW-49392, FCH858676, MFCD08234425, AKOS015854192, CA-1937, PB18852, SB10060, (S)-TETRAHYDRO-FURAN-3-YLAMINE, AJ-56048, BC213397, BP-11345, BR-75870, OR322596, PS-11982, AB0004591, AX8048904, DB-005033, ST1271436, TC-138137, BB 0261198, CS-0053253, FT-0645739, C-8351, EN300-256936, I05-0389, Oxolan-3-amine, (3R)-OXOLAN-3-AMINE, (S)-3-Aminotetrahydrofuran tosylate, ACN-047921, CB10889, 204512-95-8, 111769-26-7, 88675-24-5,

Complexity	46.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	87.068g/mol
Formal Charge	0
Heavy Atom Count	6
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	87.122g/mol
Monoisotopic Mass	87.068g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3(8)
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2733

Certificate of Analysis

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