AG003F2O

1207254-23-6 | (1,4-Oxazepan-2-yl)methanol

AG003F2O

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CAS Number	1207254-23-6
Catalog Number	AG003F2O(AGN-PC-0WA5BF)
Chemical Name	(1,4-Oxazepan-2-yl)methanol
IUPAC Name	1,4-oxazepan-2-ylmethanol
InChI	InChI=1S/C6H13NO2/c8-5-6-4-7-2-1-3-9-6/h6-8H,1-5H2
InChI Key	NOMOXHNWEMMVCR-UHFFFAOYSA-N
MDL Number	MFCD18071030
Molecular Formula	C6H13NO2
Molecular Weight	131.1729
SMILES	OCC1CNCCCO1
Synonyms	(1,4-Oxazepan-2-yl)methanol, 1207254-23-6, 2-(Hydroxymethyl)homomorpholine, [1,4]Oxazepan-2-yl-methanol, SCHEMBL2794448, NOMOXHNWEMMVCR-UHFFFAOYSA-N, 5288AJ, FCH963509, MFCD18071030, AKOS006375796, AS-32500, SY011928, AX8246505, FT-0741294, KS-00000964, Z-4137, MFCD18071030 (97+%), C6H13NO2, 1,4-Oxazepine-2-methanol,hexahydro-,

Complexity	77.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	131.095g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	131.175g/mol
Monoisotopic Mass	131.095g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	41.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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