AG00D8X3

45513-32-4 | 3-AMinoMethyl-3-hydroxyMethyloxetane

AG00D8X3

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CAS Number	45513-32-4
Catalog Number	AG00D8X3(AGN-PC-02034C)
Chemical Name	3-AMinoMethyl-3-hydroxyMethyloxetane
IUPAC Name	[3-(aminomethyl)oxetan-3-yl]methanol
InChI	InChI=1S/C5H11NO2/c6-1-5(2-7)3-8-4-5/h7H,1-4,6H2
InChI Key	GGYZOSLAJSUXRM-UHFFFAOYSA-N
MDL Number	MFCD09800579
Molecular Formula	C5H11NO2
Molecular Weight	117.1463
SMILES	OCC1(CN)COC1
Synonyms	3-Aminomethyl-3-hydroxymethyloxetane, 45513-32-4, (3-(Aminomethyl)oxetan-3-yl)methanol, [3-(Aminomethyl)oxetan-3-yl]methanol, 3-OXETANEMETHANOL, 3-(AMINOMETHYL)-, ACMC-1AOGN, SCHEMBL1458569, CTK4I8850, DTXSID40595748, GGYZOSLAJSUXRM-UHFFFAOYSA-N, HT701, ANW-30293, MFCD09800579, SBB052509, ZINC15021448, (3-Aminomethyl-oxetan-3-yl)-methanol, AKOS006339155, CS-W006858, PB29678, PS-3497, RP08343, KS-0000070F, AJ-66998, [3-(aminomethyl)oxetan-3-yl]methan-1-ol, AB0062561, DB-003364, ST2417480, TX-015509, 4CH-015473, AM20020037, FT-0649852, Z4770, B-8169, H112534, J-501079, 45513-32-4 (3-(aminomethyl)oxetan-3-yl)methanol, I14-20281, [3-(Aminomethyl)oxetan-3-yl]methanol, [3-(Hydroxymethyl)oxetan-3-yl]methylamine, C5H11NO2,

Complexity	80.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	117.079g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	117.148g/mol
Monoisotopic Mass	117.079g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314-H318
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 2735

Certificate of Analysis

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