AG002CPF

20035-41-0 | Benzaldehyde, 6-bromo-2-hydroxy-3-methoxy-

AG002CPF

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CAS Number	20035-41-0
Catalog Number	AG002CPF(AGN-PC-0JNX5N)
Chemical Name	Benzaldehyde, 6-bromo-2-hydroxy-3-methoxy-
IUPAC Name	6-bromo-2-hydroxy-3-methoxybenzaldehyde
InChI	InChI=1S/C8H7BrO3/c1-12-7-3-2-6(9)5(4-10)8(7)11/h2-4,11H,1H3
InChI Key	JUPJZUTYDWXZAQ-UHFFFAOYSA-N
MDL Number	MFCD00046152
Molecular Formula	C8H7BrO3
Molecular Weight	231.0434
NSC Number	95682
SMILES	O=CC1=C(Br)C=CC(OC)=C1O
Synonyms	6-Bromo-2-hydroxy-3-methoxybenzaldehyde, 20035-41-0, Benzaldehyde, 6-bromo-2-hydroxy-3-methoxy-, JUPJZUTYDWXZAQ-UHFFFAOYSA-N, 6-Bromo-2-hydroxy-3-methoxy-benzaldehyde, NSC95682, ACMC-1CO9Q, NCIOpen2_005952, CHEMBL93215, SCHEMBL424251, AC1L671O, AC1Q49H9, AC1Q6Q13, 3-methoxy-6-bromosalicylaldehyde, CTK1A7435, JUPJZUTYDWXZAQ-UHFFFAOYSA-, KS-00000MDI, DTXSID50294270, BDBM110974, ZINC332564, ANW-23904, MFCD00046152, NSC-95682, SBB097688, AKOS015889618, AC-9213, AN-7231, CS-7790, DS-5266, VZ30664, 2-hydroxy-3-methoxy-6-bromobenzaldehyde, 2-Hydroxy-3-methoxy-6bromo-benzaldehyde, AJ-19540, AK135966, BP-10267, SY052234, ZB010647, HY-107371, TC-112649, FT-0637938, MFCD00046152 (97%), 6-Bromo-2-hydroxy-3-methoxybenzaldehyde, 98%, A20726, AE-641/30608016, US8614253, .3-5, J-012961, I01-19606, InChI=1/C8H7BrO3/c1-12-7-3-2-6(9)5(4-10)8(7)11/h2-4,11H,1H3, AR-1H1056, CID262237, 6-Bromo-2-hydroxy-2-methoxybenzaldehyde, B1487, 20133-56-6,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.958g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	231.045g/mol
Monoisotopic Mass	229.958g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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