AG006IAW

931-44-2 | 3-Pyrrolidineethanol

AG006IAW

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CAS Number	931-44-2
Catalog Number	AG006IAW(AGN-PC-04QKGG)
Chemical Name	3-Pyrrolidineethanol
IUPAC Name	2-pyrrolidin-3-ylethanol
InChI	InChI=1S/C6H13NO/c8-4-2-6-1-3-7-5-6/h6-8H,1-5H2
InChI Key	NKRLLPCWCPIQPL-UHFFFAOYSA-N
MDL Number	MFCD09036138
Molecular Formula	C6H13NO
Molecular Weight	115.1735
SMILES	N1CC(CC1)CCO
Synonyms	3-Pyrrolidineethanol, 931-44-2, 2-(pyrrolidin-3-yl)ethanol, 2-(pyrrolidin-3-yl)ethan-1-ol, 2-PYRROLIDIN-3-YL-ETHANOL, MFCD09036138, C6H13NO, Pyrrolidine-3-ethanol, 3-hydroxyethylpyrrolidine, 2-pyrrolidin-3-ylethanol, 3-hydroxyethyl-pyrrolidine, 2-(3-Pyrrolidinyl)ethanol, SCHEMBL197440, 3-(2-hydroxyethyl)-pyrrolidine, CTK3I6545, 3-pyrrolidineethanol hydrochloride, DTXSID40504350, NKRLLPCWCPIQPL-UHFFFAOYSA-N, AKOS004121465, AKOS017344987, MCULE-3074815564, PB20322, RP08622, AN-48042, BC683601, BS-12954, SC-48001, DB-079489, AM20120341, FT-0685112, EN300-86019, P67157, Q-2158, 931P442, J-513101, I14-20291, F8880-2759, Z1259161638, 2-Methylpyridine 1-oxide, 2-(pyrrolidin-3-yl)ethan-1-ol hydrochloride,

Complexity	65.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	115.1g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	115.176g/mol
Monoisotopic Mass	115.1g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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