AG00I7RZ

39515-51-0 | 3-Phenoxybenzaldehyde

AG00I7RZ

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CAS Number	39515-51-0
Catalog Number	AG00I7RZ(AGN-PC-0WA8XB)
Chemical Name	3-Phenoxybenzaldehyde
EC Number	254-487-1
IUPAC Name	3-phenoxybenzaldehyde
InChI	InChI=1S/C13H10O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-10H
InChI Key	MRLGCTNJRREZHZ-UHFFFAOYSA-N
MDL Number	MFCD00003353
Molecular Formula	C13H10O2
Molecular Weight	198.2173
SMILES	C1=C(C=CC=C1OC2=CC=CC=C2)C=O
UNII	2ZI2173196
Synonyms	3-phenoxybenzaldehyde, 3-PHENOXYBENZALDEHYDE, 39515-51-0, 3-Phenoxy-benzaldehyde, m-Phenoxybenzaldehyde, Benzaldehyde, 3-phenoxy-, 3-Formyldiphenyl Ether, m-(Phenyloxy)benzaldehyde, 3-phenoxy benzaldehyde, UNII-2ZI2173196, EINECS 254-487-1, BRN 0511662, MRLGCTNJRREZHZ-UHFFFAOYSA-N, MFCD00003353, 2ZI2173196, DSSTox_CID_8005, DSSTox_RID_78636, DSSTox_GSID_28005, CAS-39515-51-0, 5-phenoxybenzaldehyde, m-phenoxy-benzaldehyde, meta-phenoxybenzaldehyde, 3-(phenoxy)benzaldehyde, ACMC-1CTWT, meta-phenoxy-benzaldehyde, AC1Q6PSU, Permethrin EP Impurity D, EC 254-487-1, AC1L1ZG2, M PHENOXYBENZALDEHYDE, SCHEMBL98478, 3-Phenoxybenzaldehyde, 98%, 4-08-00-00242 (Beilstein Handbook Reference), KSC293A6J, CHEMBL22531, DTXSID3028005, KS-00000VZS, MRLGCTNJRREZHZ-UHFFFAOYSA-, TIMTEC-BB SBB040220, ZINC164537, ACT06996, AKOS BBS-00003181, Tox21_202368, Tox21_303348, ANW-29112, BBL034229, SBB040220, STL363252, AKOS000268561, AN-5005, AS03381, DS-0482, MCULE-6218890350, RP25608, RTR-015794, NCGC00164346-01, NCGC00164346-02, NCGC00257412-01, NCGC00259917-01, AC-10909, AJ-16200, AK-25907, BP-12723, BR-25907, H422, LS-25140, SC-25994, ZB008191, DB-003430, TL8002854, TR-015794, AM20061089, FT-0616310, P0960, ST24032659, ST45255578, EN300-20017, 15P510, M-5062, A824597, I01-0736, J-513023, Z1741957555, 39151-15-0, InChI=1/C13H10O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-10H, C13H10O2, CID38284, C13-H10-O2, 3-Phenoxybenzaldehyde, 98% - 25G 25g, C1535, C064808,

Complexity	197
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	198.068g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	198.221g/mol
Monoisotopic Mass	198.068g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code	UN 2810

Certificate of Analysis

Lot Number