AG003DRI

36861-47-9 | 4-Methylbenzylidene camphor

AG003DRI

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CAS Number	36861-47-9
Catalog Number	AG003DRI(AGN-PC-0RCZPW)
Chemical Name	4-Methylbenzylidene camphor
EC Number	253-242-6
IUPAC Name	(3Z)-1,7,7-trimethyl-3-[(4-methylphenyl)methylidene]bicyclo[2.2.1]heptan-2-one
InChI	InChI=1S/C18H22O/c1-12-5-7-13(8-6-12)11-14-15-9-10-18(4,16(14)19)17(15,2)3/h5-8,11,15H,9-10H2,1-4H3/b14-11-
InChI Key	HEOCBCNFKCOKBX-KAMYIIQDSA-N
MDL Number	MFCD00209662
Molecular Formula	C18H22O
Molecular Weight	254.3667
SMILES	O=C1C(C(C)3C)(C)CCC3/C1=CC2=CC=C(C)C=C2
Synonyms	3-(4'-methylbenzylidene)camphor, 3-(4-methylbenzylidene)camphor, 4-MBC cpd, 4-methylbenzylidene camphor, enzacamene, Eusolex 6300, Eusolex-6300, 4-Methylbenzylidene camphor, Enzacamene, 36861-47-9, Uvinul MBC 95, Eusolex 6300, Parsol 5000, 4-Methylbenzylidenecamphor, 1,7,7-trimethyl-3-[(4-methylphenyl)methylene]bicyclo[2.2.1]heptan-2-one, Q-200329, 3-(4-Methylbenzylidene)camphor, 3-(4-Methylbenzylidene)-DL-camphor, 1,7,7-Trimethyl-3-(4-methylbenzylidene)bicyclo[2.2.1]heptan-2-one, 4-MBC, Bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-3-[(4-methylphenyl)methylene]-, Enzacamene (USP/INN), SCHEMBL83090, MLS006009981, AC1O5U39, 3-(4-Methylbenzylidene)bornan-2-one, CS-3580, 3-(4-Methylbenzylidene)camphor, 99+%, HY-17587, SMR003350767, AX8080253, ST50827105, D04013, (2Z)-4,7,7-trimethyl-2-[(4-methylphenyl)methylidene]bicyclo[2.2.1]heptan-3-one, Neo Heliopan MBC, Eusolex (TN), 4-MBC [Sunscreen], p-Methylbenzylidenecamphor, Enzacamene [USAN:INN], UNII-8I3XWY40L9, Enzacamene [USAN:USP:INN], 3-(p-Methylbenzylidene)camphor, 3-(4'-Methylbenzylidene)camphor, C18H22O, 3-(p-Methylbenzylidene)-DL-camphor, EINECS 253-242-6, 3-(p-Methylbenzylidene)bornan-2-one, C18-H22-O, (+-)-3-(p-Methylbenzylidene)camphor, CID6440721, 4-Methylbenzylidene Camphor (INCI name), 3-(2-Methoxy-5-methylphenyl)-3-phenyl propanol, 1,7,7-Trimethyl-3-(4-methylbenzylidene)bicyclo(2.2.1)heptan-2-one, (+-)-1,7,7-trimethyl-3-[(4-methylphenyl)methylene]bicyclo[2.2.1]heptan-2-one, bicyclo(2.2.1)heptan-2-one, 1,7,7-trimethyl-3-[(4-methylphenyl)methylene]-, Bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-3-[(4-methylphenyl)methylene]-, (.+-.)-, BICYCLO[2.2.1]HEPTAN-2-ONE, 1,7,7-TRIMETHYL-3-[(4-METHYLPHENYL)METHYLENE]-, (.+.)-,

Complexity	423
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	254.167g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	254.373g/mol
Monoisotopic Mass	254.167g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	4.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H361-H410
Packing Group	Ⅲ
Precautionary statements	P273-P281
UN Code	UN 3077

Certificate of Analysis

Lot Number