AG008AP7

888473-50-5 | 1H-​Pyrrole-​3-​methanamine

AG008AP7

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CAS Number	888473-50-5
Catalog Number	AG008AP7(AGN-PC-040UP3)
Chemical Name	1H-​Pyrrole-​3-​methanamine
IUPAC Name	1H-pyrrol-3-ylmethanamine
InChI	InChI=1S/C5H8N2/c6-3-5-1-2-7-4-5/h1-2,4,7H,3,6H2
InChI Key	YECAHBRVIMAHCI-UHFFFAOYSA-N
MDL Number	MFCD12964602
Molecular Formula	C5H8N2
Molecular Weight	96.1304
SMILES	C(N)c1cc[nH]c1
Synonyms	(1H-Pyrrol-3-yl)methanamine, 888473-50-5, 1H-pyrrol-3-ylmethanamine, C-(1H-Pyrrol-3-yl)-methylamine, 3-(aminomethyl)pyrrole, CTK8B7383, KS-00000OBW, 1-(1H-Pyrrol-3-yl)methanamine, DTXSID90632652, 4647AC, ANW-57153, MFCD12964602, ZINC71495166, AKOS006364729, CS-W006074, AK-67638, AJ-118098, TC-145898, 4CH-010029, ST24026070, Z-7945, Z1947438113, 1H-Pyrrole-3-methanamine, C5H8N2,

Complexity	54
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	96.069g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	96.133g/mol
Monoisotopic Mass	96.069g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	41.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

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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