AG003CX9

50966-69-3 | 1-(3-Hydroxypropyl)pyrrole

AG003CX9

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CAS Number	50966-69-3
Catalog Number	AG003CX9(AGN-PC-0NKBAA)
Chemical Name	1-(3-Hydroxypropyl)pyrrole
IUPAC Name	3-pyrrol-1-ylpropan-1-ol
InChI	InChI=1S/C7H11NO/c9-7-3-6-8-4-1-2-5-8/h1-2,4-5,9H,3,6-7H2
InChI Key	ORCXGLCMROHGOM-UHFFFAOYSA-N
MDL Number	MFCD00191453
Molecular Formula	C7H11NO
Molecular Weight	125.1683
SMILES	OCCCN1C=CC=C1
Synonyms	1-(3-Hydroxypropyl)pyrrole, 50966-69-3, 3-(1H-pyrrol-1-yl)propan-1-ol, 1H-Pyrrole-1-propanol, N-(hydroxypropyl)pyrrole, 3-pyrrol-1-yl-propanol, ACMC-209kr5, Hydroxypropylpyrrole; 97%, N-(3-hydroxypropyl)pyrrole, 3-pyrrol-1-ylpropan-1-ol, N-(3-hydroxy propyl)pyrrole, SCHEMBL422470, 1H-Pyrrole-1-(1-propanol), DTXSID80510096, ORCXGLCMROHGOM-UHFFFAOYSA-N, KS-000016FR, ZINC2556835, ANW-31167, MFCD00191453, AKOS008965270, QC-3765, AJ-39993, AS-10090, AB0091190, DB-051868, TR-018184, A7549, FT-0605630, I14-100156, H0827, 3-(1H-pyrrol-1-yl)propan-1-ol, 95% - 1G 1g,

Complexity	69.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	125.084g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	125.171g/mol
Monoisotopic Mass	125.084g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	25.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319
Precuationary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Siginal words

Certificate of Analysis

Lot Number