AG0037AG

5416-93-3 | 1-isocyanato-4-methoxybenzene

AG0037AG

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CAS Number	5416-93-3
Catalog Number	AG0037AG(AGN-PC-0JLS0E)
Chemical Name	1-isocyanato-4-methoxybenzene
EC Number	226-513-1
IUPAC Name	1-isocyanato-4-methoxybenzene
InChI	InChI=1S/C8H7NO2/c1-11-8-4-2-7(3-5-8)9-6-10/h2-5H,1H3
InChI Key	FMDGXCSMDZMDHZ-UHFFFAOYSA-N
MDL Number	MFCD00002026
Molecular Formula	C8H7NO2
Molecular Weight	149.1467
NSC Number	7321
SMILES	COC1=CC=C(C=C1)N=C=O
UNII	C50O5096NC
Synonyms	4-Methoxyphenyl isocyanate, 5416-93-3, 1-Isocyanato-4-methoxybenzene, 4-Methoxyphenylisocyanate, p-Anisyl isocyanate, Benzene, 1-isocyanato-4-methoxy-, p-Methoxyphenyl isocyanate, Isocyanic acid, p-methoxyphenyl ester, MFCD00002026, UNII-C50O5096NC, 1-isocyanato-4-methoxy-benzene, 4-Methoxyphenyl isocyanate, 99%, FMDGXCSMDZMDHZ-UHFFFAOYSA-N, C50O5096NC, 4-methoxybenzenisocyanate, 4-Methoxyisocyanatobenzene, NSC 7321, EINECS 226-513-1, PubChem1920, ACMC-209lds, p-methoxyphenylisocyanate, 4methoxyphenyl isocyanate, AC1L2XEJ, 4-methoxyphenyl-isocyanate, p-Methoxyphenyl 1socyanate, p-methoxy phenyl isocyanate, 4-methoxy phenyl isocyanate, 4-methoxy-phenyl-isocyanate, AC1Q4B0L, AC1Q6BL5, 4-(methoxy)-phenylisocyanate, 1-isocyanato 4-methoxybenzene, SCHEMBL161063, DTXSID6063854, CTK4J9876, FMDGXCSMDZMDHZ-UHFFFAOYSA-, 1-Isocyanato-4-methoxybenzene #, Benzene,1-isocyanato-4-methoxy-, NSC7321, ALBB-007514, KS-00000XD6, NSC-7321, ZINC1683477, 5276AE, ANW-31982, Isocyanic Acid 4-Methoxyphenyl Ester, SBB048851, STK504584, AKOS000121133, FS-4222, MCULE-6546966654, VZ35507, BP-12956, CJ-27734, SC-46397, DB-008411, TR-019155, BB 0259237, FT-0618811, I0440, R1031, ST50824156, I01-7086, F1945-0010, InChI=1/C8H7NO2/c1-11-8-4-2-7(3-5-8)9-6-10/h2-5H,1H3, p-Methoxyphenylisocyanat, C8H7NO2, Butyl 12-hydroxyoctadecanoate, C8-H7-N-O2, 2-Methyl-1H-indole-3-carbaldehyde, CID79443, AR-1G3233, A7876, 55583-08-9,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	149.048g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	149.149g/mol
Monoisotopic Mass	149.048g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	38.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302+H312+H332-H314
Precuationary statements	P280-P305+P351+P338-P310
Siginal words

Certificate of Analysis

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