AG003KKP

78507-19-4 | 4-((Methylamino)methyl)phenol

AG003KKP

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CAS Number	78507-19-4
Catalog Number	AG003KKP(AGN-PC-00KWT1)
Chemical Name	4-((Methylamino)methyl)phenol
IUPAC Name	4-(methylaminomethyl)phenol
InChI	InChI=1S/C8H11NO/c1-9-6-7-2-4-8(10)5-3-7/h2-5,9-10H,6H2,1H3
InChI Key	AMKMYXVFAOJGGQ-UHFFFAOYSA-N
MDL Number	MFCD09046544
Molecular Formula	C8H11NO
Molecular Weight	137.1790
SMILES	OC1=CC=C(CNC)C=C1
Synonyms	4-[(methylamino)methyl]phenol, 78507-19-4, 4-((Methylamino)methyl)phenol, Phenol, 4-[(methylamino)methyl]-, 4-Methylaminomethylphenol, 4-Methylaminomethyl-phenol, 4-(Methylamino)methylphenol, 4-(methylaminomethyl)phenol, SCHEMBL275161, CTK6I5396, ALBB-004091, KS-000009OG, 6057AJ, MFCD09046544, SBB046545, STK502911, ZINC11920608, AKOS000130333, MCULE-8286211549, TRA0069364, AJ-60548, AK-85779, AS-32286, DA-17649, SY018667, AB0057952, TC-307605, BB 0240805, FT-0736927, ST45055185, Z-4465, MFCD09046544 (97+%), C8H11NO, ACN-043850, 4-[(methylamino)methyl]phenol hydrochloride, 63989-88-8, 77668-42-9,

Complexity	87.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	137.084g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	137.182g/mol
Monoisotopic Mass	137.084g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 3259

Certificate of Analysis

Lot Number