Benzamide, 3-amino-4-chloro-
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Basic information
- CAS
19694-10-1- Standard SMILES
NC(=O)c1ccc(Cl)c(N)c1- InChIKey
QHMDKGRWJVOUFU-UHFFFAOYSA-N- Molecular formula
- C7H7ClN2O
- Average molar mass
- 170.59 g/mol
- Monoisotopic mass
- 170.0246905
Names & identifiers
- Preferred name
- Benzamide, 3-amino-4-chloro-
- IUPAC
- 3-amino-4-chlorobenzamide
- English name
- 3-Amino-4-chlorobenzamide
- Molecular formula
- C7H7ClN2O
- Molecular weight
- 170.6
Names & synonyms
3-Amino-4-chlorobenzamide19694-10-1Benzamide, 3-amino-4-chloro-EINECS 243-231-4DTXSID2066517EC 243-231-4RefChem:561441DTXCID4036140243-231-419694-86-13-Amino-4-chloro-benzamideMFCD00035785
Show more names
TIMTEC-BB SBB0038523-amino-4-chloro-benzamidBenzaMide,3-aMino-4-chloro-3-Amino-4-chlorobenzamide,98%3-AMINO-4-CHLOROBENZAMIDE, 97%%4-Chloro-3-aminobenzoic acid amide3 Amino 4 Chloro Benzamide (RM for PO-38)
3-Amino-4-chlor-benzoesaeure-amidEN300-30609SCHEMBL1808713SCHEMBL1808714SCHEMBL79137113-Amino-4-chlorobenzamide, 96%3-Amino-4-chlorobenzoic acidamideBDBM626135
Database identifiers
- CAS
19694-10-1- PubChem CID
- 88200
- DTXSID
DTXSID2066517- EC Number
- 243-231-4
- Nikkaji
- J71.702I
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 69.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Melting point
- 167 · 167-171 °C(lit.)
- Boiling point
- 307.6 · 307.6±32.0 °C(Predicted)
- Density
- 1.3789 · 1.3789 (rough estimate)
- vapor pressure
- 0.001 · 0.001-0.001Pa at 25℃
- refractive index
- 1.5618 · 1.5618 (estimate)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- pka
- 15.97 · 15.97±0.50(Predicted)
- form
- Powder
- Appearance
- White to off-white Solid
- LogP
- 0.95 at · 0.95 at 23℃ and pH7.3
- CAS DataBase Reference
- 19694 · 19694-10-1(CAS DataBase Reference)
- EPA Substance Registry System
- 3 · Benzamide, 3-amino-4-chloro- (19694-10-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (93.5%): 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 46 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationREACH registered substance: 3-amino-4-chlorobenzamide (EC: 243-231-4)
Hazard Classes and CategoriesSkin Irrit. 2 (93.5%)
Safety data
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29242998
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36-37/39
- Hazard statements
- H315-H319-H335
- REACH Registrations
- Active
- Precautionary statements
- P261-P305+P351+P338-P280a-P304+P340-P405-P501a
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzamide, 3-amino-4-chloro-: ACTIVE
Related reactions
2 records
Compound notes
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