AG00HB18

107757-05-1 | Benzenemethanol, 3-methyl-5-nitro-

AG00HB18

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	107757-05-1
Catalog Number	AG00HB18(AGN-PC-00076K)
Chemical Name	Benzenemethanol, 3-methyl-5-nitro-
IUPAC Name	(3-methyl-5-nitrophenyl)methanol
InChI	InChI=1S/C8H9NO3/c1-6-2-7(5-10)4-8(3-6)9(11)12/h2-4,10H,5H2,1H3
InChI Key	IVYZQNHRDOGBHH-UHFFFAOYSA-N
MDL Number	MFCD18399653
Molecular Formula	C8H9NO3
Molecular Weight	167.1620
SMILES	OCC1=CC([N+]([O-])=O)=CC(C)=C1
Synonyms	(3-Methyl-5-nitrophenyl)methanol, 107757-05-1, 3-Methyl-5-nitrobenzyl alcohol, SCHEMBL10155626, DTXSID70554742, 1593AA, 1594AA, MFCD18399653, ZINC34212398, AKOS016000845, AS05993, CM13447, FCH1173031, AJ-87456, AK128720, AX8250782, FT-0761246, 3-Methyl-5-nitrobenzaldehyde, C8H7NO3, C8H9NO3, 107757-06-2,

Complexity	166
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.058g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	167.164g/mol
Monoisotopic Mass	167.058g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	66A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number