AG003A56

134575-13-6 | (1α,5α,6α)-3-Azabicyclo[3.1.0]hexane-6-methanol

AG003A56

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CAS Number	134575-13-6
Catalog Number	AG003A56(AGN-PC-0PKC5H)
Chemical Name	(1α,5α,6α)-3-Azabicyclo[3.1.0]hexane-6-methanol
IUPAC Name	[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
InChI	InChI=1S/C6H11NO/c8-3-6-4-1-7-2-5(4)6/h4-8H,1-3H2/t4-,5+,6?
InChI Key	YGYOQZPGFXHQMW-XEAPYIEGSA-N
MDL Number	MFCD11099879
Molecular Formula	C6H11NO
Molecular Weight	113.1576
SMILES	OC[C@H]1[C@]2([H])CNC[C@]12[H]
Synonyms	134575-13-6, (1R,5S,6R)-3-azabicyclo[3.1.0]hexan-6-ylmethanol, EXO-3-AZABICYCLO[3.1.0]HEXANE-6-METHANOL, endo-3-Azabicyclo[3.1.0]hexane-6-methanol, 827599-22-4, cis-3-azabicyclo[3.1.0]hexan-6-ylmethanol, 289037-48-5, ((1R,5S,6r)-3-azabicyclo[3.1.0]hexan-6-yl)methanol, EN300-36123, endo-3-Azabicyclo[3.1.0]hexan-6-ylmethanol, (1R,5S)-3-azabicyclo[3.1.0]hex-6-ylmethanol, [(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methanol, [(1R,5S,6R)-3-azabicyclo[3.1.0]hexan-6-yl]methanol, azabicyclohexanylmethanol, 3-aza-bicyclo[3.1.0]hexan-6-ylmethanol, AC1Q77SA, SCHEMBL2281952, SCHEMBL2378612, SCHEMBL5325155, CTK8A2102, DTXSID30577255, YGYOQZPGFXHQMW-XEAPYIEGSA-N, PS-J-059, ZX-AT013342, 6216AA, BBL104171, FCH919845, MFCD11099879, MFCD15072014, STL557985, ZINC32628916, AKOS005146200, AKOS006356863, AKOS022171447, ZINC100028282, ZINC100047837, HE-0228, MCULE-2490334390, OR61350, PB13342, RP09628, SB10506, SB11388, AJ-85447, AS-51042, R056, SC-66356, AB0088995, AX8163725, ST1231279, CS-0049369, CS-0049601, FT-0656110, FT-0682021, Q-2775, J-500371, S14-1566, (1R,5S,6r)-3-azabicyclo[3.1.0]hex-6-ylmethanol, [(1S,5R)-3-Azabicyclo[3.1.0]hexan-6-yl]methanol, ((1R,5S,6s)-3-azabicyclo[3.1.0]hexan-6-yl)methanol, (1R,5S,6R)-(3-Azabicyclo[3.1.0]hex-6-yl)methanol, exo-3-Azabicyclo[3.1.0]hexane-6-methanol, AldrichCPR, Z1197992915, (1alpha,5alpha)-3-Azabicyclo[3.1.0]hexane-6beta-methanol, (1R,5S,6r)-rel-3-Azabicyclo[3.1.0]hexan-6-ylmethanol, (1alpha,5alpha)-3-Azabicyclo[3.1.0]hexane-6alpha-methanol, 134575-13-6 (1R,5S,6s)-3-aza-bicyclo[3.1.0]hexan-6-ylmethanol, 289037-48-5 (1R,5S,6r)-3-aza-bicyclo[3.1.0]hexan-6-ylmethanol, C6H11NO, R057, exo-3-Azabicyclo[3.1.0]hexan-6-ylmethanol, 3-Azabicyclo[3.1.0]hexane-6-methanol, (1alpha,5alpha,6alpha)-, N/A,

Complexity	94.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	113.084g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	113.16g/mol
Monoisotopic Mass	113.084g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
UN Code

Certificate of Analysis

Lot Number