Methanimidic acid, N-phenyl-, ethyl ester

HCID 111236CAS 6780-49-0
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC=Nc1ccccc1
InChIKey
DRDBNKYFCOLNQO-UHFFFAOYSA-N
Molecular formula
C9H11NO
Average molar mass
149.19 g/mol
Monoisotopic mass
149.08406397

Names & identifiers

Preferred name
Methanimidic acid, N-phenyl-, ethyl ester
IUPAC
ethyl N-phenylmethanimidate
English name
ETHYL N-PHENYLFORMIMIDATE
Molecular formula
C9H11NO
Molecular weight
149.19

Names & synonyms

Ethyl N-phenylformimidate6780-49-0ethyl N-phenylmethanimidateEthyl isoformanilideEthylisoformanilideMethanimidic acid, N-phenyl-, ethyl esterEINECS 229-841-3DTXSID9064473RefChem:811560DTXCID2045026229-841-3MFCD00043655
Show more names
ETHYL PHENYLFORMAMIDATEEthyl phenylimidoformateEthylN-Phenylformimidate>ethyl N-phenylmethanimidateEthylN-phenylformimidate,97%Ethyl N-phenylformimidate,99%Ethyl N-phenylformimidate 97%
N-Phenylformimidic Acid Ethyl EsterUNII-RB7GBA83WHEthyl phenylimidoformate #RB7GBA83WHEthyl (E)-N-phenylformimidateAKOS015917282N-Ethoxymethyleneaniline1086256-18-9

Database identifiers

CAS
6780-49-0
PubChem CID
111236
DTXSID
DTXSID9064473
UNII
RB7GBA83WH
EC Number
229-841-3
Nikkaji
J264.133J

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
21.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
11

Physicochemical properties

Boiling point
112 · 112-114 °C (33 mmHg)
Density
1.01 · 1.01
refractive index
1.526 · 1.526-1.528
Flash point
101 · 101-102°C/15mm
storage temp.
Sealed in dry,Room Temperature
form
Liquid

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

wgk
3
tsca
TSCA listed
hs_code
29221985
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationMethanimidic acid, N-phenyl-, ethyl ester: ACTIVE

Applications

UsesUsed in preparation of aldehydes from Grignard reagents.

Upstream & downstream products

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖南韵邦生物科技股份有限公司85561037 15386497078 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

Related reactions

12 records
New reaction record

Linked notes

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