AG001Z4P

173724-95-3 | 3-Pyrrolidinemethanol, 1-[(1S)-1-phenylethyl]-, (3S)-

AG001Z4P

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CAS Number	173724-95-3
Catalog Number	AG001Z4P(AGN-PC-0O4WXO)
Chemical Name	3-Pyrrolidinemethanol, 1-[(1S)-1-phenylethyl]-, (3S)-
IUPAC Name	[(3S)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]methanol
InChI	InChI=1S/C13H19NO/c1-11(13-5-3-2-4-6-13)14-8-7-12(9-14)10-15/h2-6,11-12,15H,7-10H2,1H3/t11-,12-/m0/s1
InChI Key	RQTYGPRJDFTUGU-RYUDHWBXSA-N
MDL Number	MFCD15526584
Molecular Formula	C13H19NO
Molecular Weight	205.2961
SMILES	OC[C@@H]1CN([C@H](C2=CC=CC=C2)C)CC1
Synonyms	((S)-1-((S)-1-phenylethyl)pyrrolidin-3-yl)methanol, 173724-95-3, 3-Pyrrolidinemethanol, 1-[(1S)-1-phenylethyl]-, (3S)-, SCHEMBL879237, CTK0E4255, DTXSID00454660, RQTYGPRJDFTUGU-RYUDHWBXSA-N, MFCD15526584, ZINC34152864, AKOS025146796, DS-8942, SC-34092, CID11084986, [(3S)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]methanol,

Complexity	189
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	205.147g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	205.301g/mol
Monoisotopic Mass	205.147g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	23.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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