Basic information
- CAS
774-67-4- Standard SMILES
CC(C)NC(=O)c1ccc(N)cc1- InChIKey
MTCRMEXPYUBMTJ-UHFFFAOYSA-N- Molecular formula
- C10H14N2O
- Average molar mass
- 178.23 g/mol
- Monoisotopic mass
- 178.11061307
Names & identifiers
- Preferred name
- 4-amino-N-isopropylbenzamide
- IUPAC
- 4-amino-N-propan-2-ylbenzamide
- English name
- 4-Amino-N-isopropylbenzamide
- Molecular formula
- C10H14N2O
- Molecular weight
- 178.23
Names & synonyms
4-amino-N-isopropylbenzamide774-67-4Isopropyl 4-aminobenzamide4-amino-N-(propan-2-yl)benzamide4-amino-N-propan-2-ylbenzamideMFCD009738914-Amino-N-isopropyl-benzamide(4-aminophenyl)-N-(methylethyl)carboxamideSCHEMBL853579SCHEMBL2643053DTXSID00431032MTCRMEXPYUBMTJ-UHFFFAOYSA-N
Show more names
Benzamide, 4-amino-N-(1-methylethyl)-4-?Amino-?N-?(1-?methylethyl)?-benzamide6-bromo-1,1-dioxo-1,2-benzothiazol-3-one4-amino-N-isopropylbenzamide(SALTDATA: FREE)
ALBB-002181BBL014341SBB046815STK413934AKOS0001325614-Amino-N-isopropylbenzamide, AldrichCPRDS-17136SY173820
Database identifiers
- CAS
774-67-4- PubChem CID
- 9812917
- DTXSID
DTXSID00431032- EC Number
- 809-688-4
- Nikkaji
- J1.310.817J
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 172
Physicochemical properties
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- form
- solid
- Appearance
- Off-white to yellow Solid
- InChI
- 1S/C10H14N2O/c1-7(2)12-10(13)8-3-5-9(11)6-4-8/h3-7H,11H2,1-2H3,(H,12,13)
- InChIKey
- MTCRMEXPYUBMTJ-UHFFFAOYSA-N
- SMILES
- CC(C)NC(=O)c1ccc(N)cc1
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319
- Precautionary statements
- 305 · P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-36-43
- Safety Statements
- 26 · 26
- WGK Germany
- 3 · 3
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- risk_code
- 22-36-43
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H319
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2
- Precautionary statements
- P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers24 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Hunan Jibang Biological Technology Co., LTD13776644403 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
山东领海生物科技有限公司15092083467 · [email protected]
Related reactions
2 records
Compound notes
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