AG003A5N

98955-27-2 | (4-(Methoxymethyl)cyclohexyl)methanol

AG003A5N

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CAS Number	98955-27-2
Catalog Number	AG003A5N(AGN-PC-02PT4G)
Chemical Name	(4-(Methoxymethyl)cyclohexyl)methanol
IUPAC Name	[4-(methoxymethyl)cyclohexyl]methanol
InChI	InChI=1S/C9H18O2/c1-11-7-9-4-2-8(6-10)3-5-9/h8-10H,2-7H2,1H3
InChI Key	KSIFEWSPJQDERU-UHFFFAOYSA-N
MDL Number	MFCD22571682
Molecular Formula	C9H18O2
Molecular Weight	158.2380
SMILES	COCC1CCC(CC1)CO
Synonyms	(4-(Methoxymethyl)cyclohexyl)methanol, 98955-27-2, Cyclohexanemethanol, 4-(methoxymethyl)-, [4-(methoxymethyl)cyclohexyl]methanol, KSIFEWSPJQDERU-UHFFFAOYSA-N, 4-(methoxymethyl) cyclohexanemethanol, AK153225, MMCHM, 4-(Methoxymethyl)cyclohexanemethanol, 4-Methoxymethylcyclohexylmethanol, SCHEMBL8616249, SCHEMBL20511474, 4-methoxymethyl-cyclohexylmethanol, BCP27964, MFCD22571682, ZINC81973755, AKOS024260315, ACN-052446, Cyclohexanemethanol,4-(methoxymethyl)-, DS-7399, FCH2298653, AJ-124032, AX8259770, 4CH-025123, CS-0039232, ST24034583, C9-H18-O2,

Complexity	95.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.131g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	158.241g/mol
Monoisotopic Mass	158.131g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H227-H315-H319-H335
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number