CAS:73644-95-8 / 3-methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one--Hangzhou Chempro Technology Co., Ltd.

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CAS Number: 73644-95-8
3-methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one

Structure
Name: 3-methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one
Synonyms:

General Information

Product Number: 73644958

CAS Registry Number: 73644-95-8

Name:

2H-3-Benzazepin-2-one, 1,3,4,5-tetrahydro-3-methyl-
3-Methyl-1,3,4,5-tetrahydrobenzo[d]azepin-2-one

Chemical Formula: C11H13NO
Exact Mass: 175.10
Molecular Weight: 175.23
m/z: 175.10 (100.0%), 176.10 (12.3%)

InChI: InChI=1S/C11H13NO/c1-12-7-6-9-4-2-3-5-10(9)8-11(12)13/h2-5H,6-8H2,1H3
InChIKey: NAUWUGHLFUVNQH-UHFFFAOYSA-N
Canonical SMILES : CN1CCC2=CC=CC=C2CC1=O

Thermal Properties	Value	Condition	Note
Melting Point	124.4 °C		(1)CAS
Melting Point	114.5-116.5 °C		(2)IC
Melting Point	114.5-116.5 °C	Solv: ethyl ether (60-29-7)	(3)IC

Specification

98%

References

(1) Mitchell, David; Tetrahedron: Asymmetry 2005, V16(23), P3814-3819 CAPLUS
(2) Orito, Kazuhiko; Hokkaido Daigaku Kogakubu Kenkyu Hokoku 1979, (96), P41-4 CAPLUS
(3) Orito, Kazuhiko; Tetrahedron 1980, V36(8), P1017-21 CAPLUS

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