AG00I2S9

1894060-74-2 | 3-(Pyrrolidin-2-yl)phenol hydrochloride

AG00I2S9

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CAS Number	1894060-74-2
Catalog Number	AG00I2S9(AGN-PC-0WNGJJ)
Chemical Name	3-(Pyrrolidin-2-yl)phenol hydrochloride
IUPAC Name	3-pyrrolidin-2-ylphenol;hydrochloride
InChI	InChI=1S/C10H13NO.ClH/c12-9-4-1-3-8(7-9)10-5-2-6-11-10;/h1,3-4,7,10-12H,2,5-6H2;1H
InChI Key	UGHPGTAUHOKERV-UHFFFAOYSA-N
MDL Number	MFCD30471573
Molecular Formula	C10H14ClNO
Molecular Weight	199.6773
SMILES	OC1=CC=CC(C2NCCC2)=C1.[H]Cl
Synonyms	3-(Pyrrolidin-2-yl)phenol hydrochloride, 1894060-74-2, 3-(Pyrrolidin-2-yl)phenol HCl, KS-00000U3L, MFCD30471573, AK608020, DS-19796, (R)-3-(PYRROLIDIN-2-YL)PHENOL HCL, (S)-3-(PYRROLIDIN-2-YL)PHENOL HCL,

Complexity	149
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.076g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	199.678g/mol
Monoisotopic Mass	199.076g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

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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