AG008RCT

1048962-84-0 | (3S)-Tetrahydro-3-furanmethanamine

AG008RCT

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CAS Number	1048962-84-0
Catalog Number	AG008RCT(AGN-PC-0NVX5L)
Chemical Name	(3S)-Tetrahydro-3-furanmethanamine
IUPAC Name	[(3S)-oxolan-3-yl]methanamine
InChI	InChI=1S/C5H11NO/c6-3-5-1-2-7-4-5/h5H,1-4,6H2/t5-/m0/s1
InChI Key	CINJIXGRSTYIHP-YFKPBYRVSA-N
MDL Number	MFCD17015964
Molecular Formula	C5H11NO
Molecular Weight	101.1469
SMILES	NC[C@H]1COCC1
Synonyms	1048962-84-0, (S)-(tetrahydrofuran-3-yl)methanamine, (S)-1-Tetrahydrofuran-3-ylmethanamine, (3S)-Tetrahydro-3-furanmethanamine, [(3S)-oxolan-3-yl]methanamine, 3-Furanmethanamine, tetrahydro-, (3S)-, AK170332, AMOT0061, SCHEMBL3700103, CINJIXGRSTYIHP-YFKPBYRVSA-N, (S)-tetrahydrofuran-3-ylmethylamine, MFCD17015964, ZINC12953727, AKOS024438328, FCH1174603, KS-000003C9, [(3S)-Tetrahydrofuran-3-yl]methanamine, (S);-(Tetrahydrofuran-3-yl);methanamine, AJ-63120, AS-51166, ST1271434, AM20070699, CS-0053039, FT-0771165, Q-3517, 962T840, (3S)-oxolan-3-ylmethanamine, (S)-(TETRAHYDROFURAN-3-YL)METHANAMINE HCL, (S)-1-TETRAHYDROFURAN-3-YLMETHANAMINE HYDROCHLORIDE,

Complexity	56
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	101.084g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	101.149g/mol
Monoisotopic Mass	101.084g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H302-H315-H318-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

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