AG006IO3

90221-55-9 | 2-Bromo-5-methylbenzaldehyde

AG006IO3

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CAS Number	90221-55-9
Catalog Number	AG006IO3(AGN-PC-00HCV5)
Chemical Name	2-Bromo-5-methylbenzaldehyde
IUPAC Name	2-bromo-5-methylbenzaldehyde
InChI	InChI=1S/C8H7BrO/c1-6-2-3-8(9)7(4-6)5-10/h2-5H,1H3
InChI Key	UWGFRLQHWDMILE-UHFFFAOYSA-N
MDL Number	MFCD08669550
Molecular Formula	C8H7BrO
Molecular Weight	199.0446
SMILES	O=CC1=CC(C)=CC=C1Br
Synonyms	2-BROMO-5-METHYLBENZALDEHYDE, 90221-55-9, Benzaldehyde, 2-bromo-5-methyl-, 2-bromo-5-methyl-benzaldehyde, PubChem16748, KSC912M5D, SCHEMBL135760, ACMC-209r59, CTK8B2651, KS-00000IED, DTXSID10474354, UWGFRLQHWDMILE-UHFFFAOYSA-N, ANW-39451, CL8258, MFCD08669550, ZINC16054469, AKOS006238806, CS-W004919, GS-3993, LS10095, 2-Bromo-5-methylbenzaldehyde, AldrichCPR, AJ-68094, AK-76557, AM804522, BC004142, BR-76557, CJ-15269, SC-26080, SY110421, AB0044067, DB-030831, TC-128196, 4CH-009233, FT-0687006, ST24027847, W9291, MFCD08669550 (95%), A-3601, I01-9262, C8H7BrO, ACN-056156, CID11845896, B5824,

Complexity	124
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.968g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	199.047g/mol
Monoisotopic Mass	197.968g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number